1-allyl-2,2,7,7-tetramethyl cycloheptanol
chinchilol
 
Notes:
None found
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CAS Number: 105463-44-3Picture of molecule3D/inchi
Nikkaji Web: J120.484J
XlogP3-AA: 4.50 (est)
Molecular Weight: 210.36042000
Formula: C14 H26 O
NMR Predictor: Predict (works with chrome or firefox)
Category: fragrance agents
 
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.94200 to 0.95900 @  20.00 °C.
Pounds per Gallon - (est).: 7.848 to  7.989
Refractive Index: 1.49000 to 1.50000 @  20.00 °C.
Boiling Point: 198.00 to  200.00 °C. @ 111.00 mm Hg
Vapor Pressure: 0.002000 mmHg @ 25.00 °C. (est)
Flash Point: > 212.00 °F. TCC ( > 100.00 °C. )
logP (o/w): 4.795 (est)
Soluble in:
 alcohol
 water, 4.813 mg/L @ 25 °C (est)
Insoluble in:
 water
Stability:
 ph from 6 - 11
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Organoleptic Properties:
 
Odor Type: herbal
 
Odor Strength: medium
 
Substantivity: 64 hour(s) at 100.00 %
 
 woody  camphoreous  patchouli  earthy  rooty  
Odor Description:
at 100.00 %. 
woody camphor patchouli earthy rooty
Luebke, William tgsc, (1991)
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
 None found
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Safety Information:
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
oral-rat LD50  > 5000 mg/kg
Luebke, William tgsc, (1991)

Dermal Toxicity:
skin-rabbit LD50 > 2000 mg/kg
Luebke, William tgsc, (1991)

Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: fragrance agents
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
IFRA Purity Specification: < 0.1% free allyl alcohol
Recommendation for 1-allyl-2,2,7,7-tetramethyl cycloheptanol usage levels up to:
  2.0000 % in the fragrance concentrate.
 
Recommendation for 1-allyl-2,2,7,7-tetramethyl cycloheptanol flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
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EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 184493
National Institute of Allergy and Infectious Diseases: Data
 2,2,7,7-tetramethyl-1-prop-2-enylcycloheptan-1-ol
Chemidplus: 0105463443
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References:
 2,2,7,7-tetramethyl-1-prop-2-enylcycloheptan-1-ol
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 184493
Pubchem (sid): 135161769
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2906.19.020
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
No odor group found for these
 dehydrolinaloolFL/FR
(E)-1,5-octadien-3-ol 
alliaceous
 dipropyl disulfideFL/FR
amber
 angelica archangelica root oil CO2 extractFL/FR
animal
isobutyl quinolineFR
 indoletalFR
1-oxaspiro-4,7-dodecaneFR
anise
sweet fennel seed oilFL/FR
balsamic
dextro-borneolFL/FR
laevo-borneolFL/FR
dextro,laevo-borneolFL/FR
dextro,laevo-isoborneolFL/FR
isobornyl acetateFL/FR
isobornyl formateFL/FR
 bornyl formateFL/FR
isobornyl methyl etherFL/FR
isobornyl propionateFL/FR
T-cadinolFL/FR
 cedar forest fragranceFR
 conifer acetateFR
dextro-fenchoneFL/FR
 fir needle oil siberiaFL/FR
camphoreous
dextro-camphorFL/FR
2,6-dimethyl-3-oxatricyclo(4.2.1.0*2,4*)nonaneFR
citrus
(E+Z)-4,8-dimethyl-3,7-nonadien-2-yl acetateFL/FR
 grapefruit oil terpenelessFL/FR
 marine nitrileFR
 neroli ketoneFR
 ocimene quintoxideFL/FR
coconut
delta-heptalactoneFL/FR
 bean pyrazineFL/FR
6(or 8)-isobutyl quinolineFR
 dibenzyl etherFL/FR
2-ethyl fencholFL/FR
2-ethyl hexyl acetateFL/FR
2-ethyl-3-methoxypyrazineFL/FR
(-)-alpha-fencholFL/FR
 gentian concreteFR
 geosminFL/FR
 geosminFL/FR
 heptanal cyclic acetal with glycerolFL/FR
 heptanal glyceryl acetalFL/FR
(Z)-linalool oxide (furanoid)FL/FR
 methyl 3-hexenoateFL/FR
 methyl undecylenateFL/FR
 muscogeneFR
1-nonen-3-olFL/FR
 nutty pyrazineFL/FR
3-octanolFL/FR
2-octanoneFL/FR
(Z)-4-octen-1-olFL/FR
3-octen-2-oneFL/FR
1-octen-3-olFL/FR
1-octen-3-oneFL/FR
 octyl phenyl acetateFL/FR
 patchouli cyclohexanolFR
scotch pine needle oilFL/FR
scotch pine needle oil estoniaFL/FR
scotch pine needle oil yugoslaviaFL/FR
 spathulenol 
fatty
3-decen-2-oneFL/FR
(E)-2-decenalFL/FR
 methyl 10-undecenoateFL/FR
 methyl 2-hexenoateFL/FR
floral
isoamyl salicylateFL/FR
 anise indeneFR
 bigarade oxideFR
 bois de rose oil peruFL/FR
 dihydro-alpha-iononeFL/FR
 earthy indaneFR
 floral methanolFR
 geranium oil moroccoFL/FR
 ho leaf oilFR
(Z)-jasmoneFL/FR
 karo karounde absoluteFR
 lavandula angustifolia flower oilFL/FR
 lavender oil franceFL/FR
 lavender oil greeceFL/FR
 lilac pentanolFL/FR
 linalool oxideFL/FR
2-methyl-4-phenyl butanalFL/FR
 nonisyl propionateFR
 octyl acetateFL/FR
 petitgrain bigarade oilFL/FR
 phenyl acetaldehyde 2,3-butylene glycol acetalFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
2-phenyl propionaldehyde ethylene glycol acetalFR
2-phenyl propyl acetateFL/FR
 prenyl salicylateFL/FR
 sambucus nigra flower oil CO2 extractFR
5-tricyclodecenyl acetateFR
fruity
3-allyl oxy-1,4-dimethyl bicyclo(3.2.1)octaneFR
 amyl formateFL/FR
3-benzyl-4-heptanoneFL/FR
 butyl propionateFL/FR
2-methyl butyl isovalerateFL/FR
2-nonanoneFL/FR
 octyl butyrateFL/FR
2-pentyl furanFL/FR
 rhubarb pyranFR
 styralyl butyrateFL/FR
 tropical thiazoleFL/FR
 tropical trithianeFL/FR
fungal
 hydroxymethyl hexyl ethyl ketoneFL/FR
green
isoamyl formateFL/FR
 cortex pyridineFL/FR
 cumin acetaldehydeFL/FR
isocyclocitral (IFF)FL/FR
 dicyclopentadiene propionateFR
 earthy acetalFL/FR
 fern absolute 
 galbanum oilFL/FR
 galbanum resinoid replacerFR
 geranium absoluteFL/FR
(E)-3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
alpha-hexyl cinnamaldehyde dimethyl acetalFR
(Z)-leaf acetalFL/FR
 methyl cyclocitrone (IFF)FR
para-methyl hydratropaldehydeFL/FR
(Z)-1,5-octadien-3-ol 
 phenyl acetaldehyde dimethyl acetalFL/FR
1-phenyl-2-pentanolFL/FR
2-propenyl-para-cymeneFR
4-isopropyl quinolineFL/FR
isopropyl quinolineFR
3,5,5-trimethyl hexanolFL/FR
 valerian rhizome oil CO2 extract chinaFL/FR
 violet leaf absoluteFL/FR
hay
 tobacco leaf absoluteFL/FR
herbal
 angelica archangelica seed extractFL/FR
 artemisia vestita wall. leaf oilFR
 barosma betulina leaf oilFL/FR
 bornyl 2-methyl butyrateFL/FR
 bornyl butyrateFL/FR
beta-bourboneneFL/FR
delta-cadinene 
alpha-cadinolFL/FR
 calamintha clinopodium oilFR
 camphene carbinolFR
 camphene carbinyl acetateFR
 cardamom liquid resinFR
 celery undeceneFR
 chamomile oil moroccoFR
 coriander oleoresinFL/FR
 dill seed oilFL/FR
 dill seed oil CO2 extractFL/FR
 dimethyl cyclormol (IFF)FR
2,10-epoxypinaneFR
 geranic oxideFL/FR
 herbal dioxaneFR
 herbal ketoneFR
 herbal undecanoneFR
6-hydroxydihydrotheaspirane (mixture of isomers)FL/FR
 immortelle flower oilFL/FR
 lavandin water absoluteFL/FR
2-methyl butyl salicylateFL/FR
 methyl cyclogeranate (Firmenich)FR
2-methyl-3-buten-2-olFL/FR
 origanum oilFL/FR
 origanum oil greeceFL/FR
curled parsley leaf oilFL/FR
 pine hexanolFR
alpha-pineneFL/FR
 pinocarveolFL/FR
 rosemary absoluteFL/FR
 rosemary oilFL/FR
 rosemary oil africaFL/FR
 rosemary oil moroccoFL/FR
 rosemary oil spainFL/FR
 rosemary oil tunisiaFL/FR
 tea leaf absoluteFL/FR
 thyme oil wild or creepingFL/FR
 tricyclodecenyl propionateFR
 valerian rhizome oilFL/FR
 valerian rhizome oil chinaFL/FR
medicinal
2,6-xylenolFL/FR
mentholic
 peppermint cyclohexanoneFL/FR
minty
 pennyroyal oilFL/FR
mossy
 oakmoss absoluteFL/FR
 veramoss (IFF)FR
mushroom
(R)-1-octen-3-olFL/FR
musk
 angelica root absoluteFL/FR
musty
 menthofuranFL/FR
naphthyl
ortho-methyl anisoleFL/FR
nutty
2-acetyl-3-ethyl pyrazineFL/FR
 filbert pyrazineFL/FR
2-methyl thio-3,5 or 6-methyl pyrazineFL/FR
2-methyl-3-ethoxypyrazineFL/FR
2,3,5-trimethyl pyrazineFL/FR
 vinyl sulfurolFL/FR
orris
para-isopropyl acetophenoneFL/FR
phenolic
4-methyl-2,6-dimethoxyphenolFL/FR
spicy
 bayberry fragranceFR
 carvacrolFL/FR
4-carvomenthenolFL/FR
alpha-caryophyllene alcoholFL/FR
beta-caryophyllene alcoholFL/FR
 caryophyllene alcoholFL/FR
 cinnamon acroleinFL/FR
black currant bud absoluteFL/FR
 ginger oleoresinFL/FR
 ginger oleoresin africaFL/FR
 ginger root absoluteFL/FR
 ginger root oil cochinFL/FR
 myrceneFR
2-octanolFL/FR
 origanum majorana oilFL/FR
 origanum majorana oil cubaFL/FR
black pepper absoluteFL/FR
white pepper oilFL/FR
black pepper oilFL/FR
black pepper oleoresinFL/FR
4-isopropyl-2-cyclohexenoneFL/FR
white sassafras oilFL/FR
sulfurous
 cassis pentanoneFL/FR
terpenic
 cypress leaf oilFR
thujonic
 cedarleaf oil terpenelessFR
 cedarleaf oil western redFR
common tansy flower oil argentinaFL/FR
common tansy leaf oil dutchFR
 woody ketoneFL/FR
tonka
 melilot absoluteFR
vegetable
 methionalFL/FR
waxy
1-dodecanolFL/FR
 octyl isobutyrateFL/FR
2-tridecanoneFL/FR
woody
 angelica archangelica root extractFL/FR
 angelica archangelica root tinctureFL/FR
 angelica archangelica root waterFL/FR
 bruyere root oilFR
para-tert-butyl cyclohexanoneFR
2-tert-butyl cyclohexanoneFR
(R)-gamma-cadinene 
 cadineneFL/FR
(+)-campheneFL/FR
 campheneFL/FR
beta-caryophyllene alcohol acetateFL/FR
alpha-cedrene epoxideFR
 cistus twig/leaf oilFL/FR
 cyperus root oil (cyperus scariosus)FR
 cypress essenceFR
 dalbergia sissoo leaf oilFR
 dihydro-alpha-terpinyl acetateFR
 dihydro-beta-iononeFL/FR
 fougere woody fragranceFR
 germacrene B 
 herbal norbornaneFR
 hinoki root oilFR
 juniper berry oil terpenesFR
 laitoneFR
isolongifolene ketoneFR
 manevoro oilFR
 marine formateFR
 melaleuca bracteata leaf oilFR
delta-methyl iononeFL/FR
gamma-muurolene 
 orris hexanoneFR
 patchouli alcoholFR
 patchouli ethanolFR
 patchouli hexanolFR
 patchouli oilFL/FR
 pinacolFR
 polylimoneneFL/FR
 santol pentenolFR
 spruce needle oil canadaFL/FR
beta-terpineolFL/FR
 tetrahydromugolFR
 verdoxanFR
 vetiver oil acetylatedFR
 vetiver oil CO2 extractFL/FR
 vetiver oil fractionsFR
 vetiver oil haitiFL/FR
 vetiver resinoidFR
 vetiverolFL/FR
 vetiveryl acetateFL/FR
 woody dodecaneFR
 woody epoxideFR
 woody etherFR
 
For Flavor
 
No flavor group found for these
 angelica archangelica root extractFL/FR
 angelica archangelica root oil CO2 extractFL/FR
 angelica archangelica root tinctureFL/FR
 angelica archangelica root waterFL/FR
 bean pyrazineFL/FR
 benzyl disulfideFL
dextro,laevo-borneolFL/FR
dextro-borneolFL/FR
 bornyl 2-methyl butyrateFL/FR
 bornyl butyrateFL/FR
 bornyl formateFL/FR
isobornyl methyl etherFL/FR
beta-bourboneneFL/FR
delta-cadinene 
(R)-gamma-cadinene 
alpha-cadinolFL/FR
T-cadinolFL/FR
(+)-campheneFL/FR
alpha-caryophyllene alcoholFL/FR
 caryophyllene alcoholFL/FR
beta-caryophyllene alcoholFL/FR
beta-caryophyllene alcohol acetateFL/FR
 dehydrolinaloolFL/FR
 dimethyl dihydrocyclopentapyrazineFL
(E+Z)-4,8-dimethyl-3,7-nonadien-2-yl acetateFL/FR
 earthy acetalFL/FR
 elecampane root absoluteFL
 elecampane root oilFL
2-ethyl hexyl acetateFL/FR
2-ethyl-3-methoxypyrazineFL/FR
2-ethyl-4,5-dimethyl oxazoleFL
 fern absolute 
 geosminFL/FR
 germacrene B 
 green pea pyrazineFL
 heptanal cyclic acetal with glycerolFL/FR
 heptanal glyceryl acetalFL/FR
 hydroxymethyl hexyl ethyl ketoneFL/FR
(Z)-linalool oxide (furanoid)FL/FR
2-methoxy-3-propyl pyrazineFL
 methyl 2-hexenoateFL/FR
2-methyl butyl salicylateFL/FR
delta-methyl iononeFL/FR
1-methyl pyrroleFL
tris(methyl thio) methaneFL
2-methyl-3-buten-2-olFL/FR
2-methyl-3-ethoxypyrazineFL/FR
2-methyl-4-phenyl butanalFL/FR
gamma-muurolene 
1,5-octadien-3-olFL
(E)-1,5-octadien-3-ol 
(Z)-1,5-octadien-3-ol 
1,5-octadien-3-oneFL
(Z)-4-octen-1-olFL/FR
 octyl phenyl acetateFL/FR
(E)-2-penten-1-olFL
 phenyl acetaldehyde 2,3-butylene glycol acetalFL/FR
2-phenyl propyl acetateFL/FR
scotch pine needle oilFL/FR
scotch pine needle oil estoniaFL/FR
scotch pine needle oil yugoslaviaFL/FR
 polylimoneneFL/FR
4-isopropyl quinolineFL/FR
4-isopropyl-2-cyclohexenoneFL/FR
white sassafras oilFL/FR
 spathulenol 
beta-terpineolFL/FR
 vetiveryl acetateFL/FR
 woody ketoneFL/FR
alliaceous
 dipropyl disulfideFL/FR
 tropical thiazoleFL/FR
anise
sweet fennel seed oilFL/FR
astringent
2,3-dimethyl quinoxalineFL
balsamic
isobornyl propionateFL/FR
 fir needle oil siberiaFL/FR
berry
 dihydro-alpha-iononeFL/FR
burnt
2,6-xylenolFL/FR
camphoreous
dextro,laevo-isoborneolFL/FR
laevo-borneolFL/FR
 campheneFL/FR
(-)-alpha-fencholFL/FR
 geranic oxideFL/FR
6-hydroxydihydrotheaspirane (mixture of isomers)FL/FR
ortho-methyl anisoleFL/FR
 pinocarveolFL/FR
 rosemary oil tunisiaFL/FR
2-nonanoneFL/FR
citrus
 grapefruit oil terpenelessFL/FR
 petitgrain bigarade oilFL/FR
coffee
 methyl furfuryl mercaptopropionateFL
cooling
4-carvomenthenolFL/FR
dextro-fenchoneFL/FR
creamy
3-octen-2-oneFL/FR
 octyl isobutyrateFL/FR
dairy
2-octanoneFL/FR
earthy
2-ethyl fencholFL/FR
 geosminFL/FR
1-nonen-3-olFL/FR
1,8-octane dithiolFL
1-octen-3-oneFL/FR
fatty
2-tridecanoneFL/FR
floral
 bois de rose oil peruFL/FR
 geranium oil moroccoFL/FR
fruity
 amyl formateFL/FR
3-benzyl-4-heptanoneFL/FR
 butyl propionateFL/FR
 dibenzyl etherFL/FR
 lilac pentanolFL/FR
 methyl 3-hexenoateFL/FR
2-methyl butyl isovalerateFL/FR
2-phenyl propionaldehyde dimethyl acetalFL/FR
1-phenyl-2-pentanolFL/FR
 styralyl butyrateFL/FR
 tropical trithianeFL/FR
 valerian rhizome oilFL/FR
 valerian rhizome oil chinaFL/FR
 valerian rhizome oil CO2 extract chinaFL/FR
grassy
 tobacco leaf absoluteFL/FR
green
isoamyl formateFL/FR
isoamyl salicylateFL/FR
 cassis pentanoneFL/FR
 cortex pyridineFL/FR
 cumin acetaldehydeFL/FR
isocyclocitral (IFF)FL/FR
3-decen-2-oneFL/FR
 galbanum oilFL/FR
 geranium absoluteFL/FR
(E)-3-hexen-1-olFL/FR
(Z)-3-hexen-1-yl tiglateFL/FR
(Z)-leaf acetalFL/FR
 linalool oxideFL/FR
para-methyl hydratropaldehydeFL/FR
 oakmoss absoluteFL/FR
 ocimene quintoxideFL/FR
2-pentyl furanFL/FR
 phenyl acetaldehyde dimethyl acetalFL/FR
 propylene glycol acetone ketalFL
3,5,5-trimethyl hexanolFL/FR
 violet leaf absoluteFL/FR
herbal
 angelica archangelica seed extractFL/FR
 barosma betulina leaf oilFL/FR
 coriander oleoresinFL/FR
 dill seed oilFL/FR
 dill seed oil CO2 extractFL/FR
 immortelle flower oilFL/FR
 lavandin water absoluteFL/FR
 lavandula angustifolia flower oilFL/FR
 lavender oil franceFL/FR
 lavender oil greeceFL/FR
 origanum majorana oilFL/FR
 origanum oilFL/FR
 origanum oil greeceFL/FR
curled parsley leaf oilFL/FR
 prenyl salicylateFL/FR
 rosemary absoluteFL/FR
 rosemary oilFL/FR
 rosemary oil africaFL/FR
 rosemary oil moroccoFL/FR
 rosemary oil spainFL/FR
 thyme oil wild or creepingFL/FR
lactonic
delta-heptalactoneFL/FR
medicinal
dextro-camphorFL/FR
mentholic
 peppermint cyclohexanoneFL/FR
milky
dextro,laevo-3-(methyl thio) butanoneFL
minty
 pennyroyal oilFL/FR
mushroom
1-octen-3-olFL/FR
(R)-1-octen-3-olFL/FR
musk
 angelica root absoluteFL/FR
musty
 menthofuranFL/FR
3-octanolFL/FR
 propionaldehydeFL
2,3,5-trimethyl pyrazineFL/FR
nutty
2-acetyl-1-methyl pyrroleFL
2-acetyl-3-ethyl pyrazineFL/FR
 filbert pyrazineFL/FR
2-methyl thio-3,5 or 6-methyl pyrazineFL/FR
 nutty pyrazineFL/FR
 vinyl sulfurolFL/FR
phenolic
4-methyl-2,6-dimethoxyphenolFL/FR
 propyl 2-furoateFL
soapy
1-dodecanolFL/FR
solvent
2-ethyl furanFL
spicy
 carvacrolFL/FR
 cinnamon acroleinFL/FR
black currant bud absoluteFL/FR
 ginger oleoresinFL/FR
 ginger oleoresin africaFL/FR
 ginger root absoluteFL/FR
 ginger root oil cochinFL/FR
2-octanolFL/FR
 origanum majorana oil cubaFL/FR
black pepper absoluteFL/FR
black pepper oilFL/FR
white pepper oilFL/FR
black pepper oleoresinFL/FR
para-isopropyl acetophenoneFL/FR
 turmeric oleoresinFL
sulfurous
 diphenyl disulfideFL
 potato butanoneFL
tea
 tea leaf absoluteFL/FR
thujonic
common tansy flower oil argentinaFL/FR
tomato
 methionalFL/FR
vegetable
 radish isothiocyanateFL
waxy
(E)-2-decenalFL/FR
 methyl 10-undecenoateFL/FR
 methyl undecylenateFL/FR
 octyl 2-furoateFL
 octyl acetateFL/FR
 octyl butyrateFL/FR
winey
5-ethyl-2-methyl pyridineFL
woody
isobornyl acetateFL/FR
isobornyl formateFL/FR
 cadineneFL/FR
 cistus twig/leaf oilFL/FR
 dihydro-beta-iononeFL/FR
(Z)-jasmoneFL/FR
 patchouli oilFL/FR
alpha-pineneFL/FR
 spruce needle oil canadaFL/FR
 vetiver oil CO2 extractFL/FR
 vetiver oil haitiFL/FR
 vetiverolFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 ambergrisFR
 chypreFR
 earthFR
 fernFR
 herbalFR
 patchouliFR
 rootFR
 woodyFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
1-allyl-2,2,7,7-tetramethylcycloheptanol
 chinchilol
 cycloheptanol, 2,2,7,7-tetramethyl-1-(2-propen-1-yl)-
 cycloheptanol, 2,2,7,7-tetramethyl-1-(2-propenyl)-
2,2,7,7-tetramethyl-1-prop-2-enyl cycloheptan-1-ol
2,2,7,7-tetramethyl-1-prop-2-enylcycloheptan-1-ol
Synonyms   Articles   Notes   Search   Top
Synonyms   Articles   Notes   Search   Top
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