Results for:
PubChem ID: 443162

2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol

Mass-Spectra

Compound Details

Synonymous names	10482-56-1 (-)-alpha-Terpineol (L)-alpha-Terpineol (S)-(-)-Terpineol (S)-alpha-terpineol 2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol a-Terpineol (S)-(-)-alpha-terpineol (S)-p-Menth-1-en-8-ol L-.alpha.-Terpineol (S)-2-(4-Methyl-3-cyclohexenyl)-2-propanol (S)-2-(4-methylcyclohex-3-en-1-yl)propan-2-ol p-Menth-1-en-8-ol, (S)-(-)- .alpha.-Terpineol, (-)- (-?)?-?|A-?Terpineol CHEBI:128 (4S)-p-menth-1-en-8-ol N9K6X87HU9 DTXSID5052672 1-alpha-terpineol (S)-(-)-p-menth-1-en-8-ol 3-Cyclohexene-1-methanol, a,a,4-trimethyl-, (1S)- L-alpha-TERPINEOL 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, (1S)- (S)-alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol alpha-Terpinenol (1S)-alpha,alpha,4-trimethyl-3-cyclohexene-1-methanol alpha-Terpineol, (+)- 21M14KDA67 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, (S)- UNII-21M14KDA67 MFCD00075926 HSDB 2683 (S)--erpineol (-)-a-Terpineol EINECS 233-986-8 (-)--erpineol 1-.alpha.-Terpineol (-)-.alpha.-Terpineol (R)-alpha,alpha,4-Trimethylcyclohex-3-ene-1-methanol bmse000667 (+)-?-TERPINEOL UNII-N9K6X87HU9 (-)-(4S)-alpha-terpineol SCHEMBL980991 CHEMBL447597 DTXCID2031245 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (S)- HY-N1467 XGE EINECS 232-081-5 Tox21_303728 AKOS015913019 p-Menth-1-en-8-ol (S)-(-)- CCG-266247 NCGC00357037-01 BS-42439 CAS-10482-56-1 CS-0016960 NS00126470 S5594 2-(4-methyl-1-cyclohex-3-enyl)propan-2-ol alpha-Terpineol, natural, >=96%, FCC, FG EN300-7698260 J-500016 2-(4-Methyl-3-cyclohexen-1-yl)-2-propanol, (S)- Q27105253 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (1R)- 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (1S)- 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, (theta)-
Microorganism:	Yes
IUPAC name	2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-ol
SMILES	CC1=CCC(CC1)C(C)(C)O
Inchi	InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1
Formula	C10H18O
PubChem ID	443162
Molweight	154.25
LogP	1.8
Atoms	11
Bonds	1
H-bond Acceptor	1
H-bond Donor	1
Chemical Classification	alcohols terpenes
CHEBI-ID	128
Supernatural-ID	SN0420414-01

mVOC Specific Details

Boiling Point	Degree Reference 80-81.5 deg C @ 5 mm Hg O'Neil, M.J. (ed.). The Merck Index - An Encyclopedia of Chemicals, Drugs, and Biologicals. 13th Edition, Whitehouse Station, NJ: Merck and Co., Inc., 2001., p. 1637
Vapor Pressure	Pressure Reference 5 mm Hg @ 80 to 81 mm Hg Riddick, J.A., W.B. Bunger, Sakano T.K. Techniques of Chemistry 4th ed., Volume II. Organic Solvents. New York, NY: John Wiley and Sons., 1985., p. 261
MS-Links	MS-MS Spectrum 2356 MS-MS Spectrum 2355 MS-MS Spectrum 2357
1D-NMR-Links	1D NMR Spectrum 4664 1D NMR Spectrum 1988
Massbank-Links	Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP005329 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP007571 Massbank Spectrum MSBNK-Fac_Eng_Univ_Tokyo-JP008378

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Eukaryota Aspergillus Fumigatus NA NA Heddergott et al. 2014 Eukaryota Gloeophyllum Odoratum na Sachsenwald near Hamburg Rösecke et al. 2000 Prokaryota Pseudomonas Sp. NA NA Etminani et al. 2022
Method	Kingdom Species Growth Medium Applied Method Verification Eukaryota Aspergillus Fumigatus Brian alendronate supp. SPME/GC-MS no Eukaryota Gloeophyllum Odoratum na GC/MS no Prokaryota Pseudomonas Sp. nutrient agar (NA) GC–MS no