Record Information
Version1.0
Creation date2010-04-08 22:10:36 UTC
Update date2019-11-27 17:23:57 UTC
Primary IDFDB013253
Secondary Accession NumbersNot Available
Chemical Information
FooDB NameMenthanol
DescriptionPresent in lemon and spearmint oils. Menthanol is found in citrus, fats and oils, and pine nut.
CAS Number498-81-7
Structure
Thumb
Synonyms
SynonymSource
α-dihydroterpineolbiospider
1-(1-Hydroxy-1-methylethyl)-4-methylcyclohexanedb_source
1-Methyl-4-isopropylcyclohexane-8-olbiospider
2-(4-Methylcyclohexyl)-2-propanolbiospider
a,a,4-Trimethylcyclohexanemethanol, 9CIdb_source
alpha -DihydroterpineolHMDB
alpha,alpha,4-Trimethyl-cis-cyclohexanemethanolHMDB
alpha,alpha,4-Trimethyl-cyclohexanemethanolHMDB
alpha,alpha,4-Trimethyl-trans-cyclohexanemethanolHMDB
Alpha,alpha,4-trimethylcyclohexanemethanolbiospider
cis-alpha,alpha,4-Trimethylcyclohexanemethanolbiospider
Cyclohexanemethanol, alpha,alpha,4-trimethyl-biospider
Cyclohexanemethanol, alpha,alpha,4-trimethyl-, cis-biospider
Cyclohexanemethanol, alpha,alpha,4-trimethyl-, trans-biospider
Dihydro-α-terpineolbiospider
Dihydro-a-terpineoldb_source
dihydro-alpha -TerpineolHMDB
Dihydro-alpha-terpineolbiospider
dihydro-TerpineolHMDB
Menthanoldb_source
Terpineol, dihydro-biospider
trans-(1)-alpha,alpha,4-Trimethylcyclohexanemethanolbiospider
trans-2-(4-Methylcyclohexyl)isopropanolbiospider
trans-alpha,alpha,4-Trimethylcyclohexanemethanolbiospider
trans-p-Menthan-8-olbiospider
Predicted PropertiesNot Available
Chemical FormulaC10H20O
IUPAC name
InChI IdentifierInChI=1S/C10H20O/c1-8-4-6-9(7-5-8)10(2,3)11/h8-9,11H,4-7H2,1-3H3
InChI KeyUODXCYZDMHPIJE-UHFFFAOYSA-N
Isomeric SMILESCC1CCC(CC1)C(C)(C)O
Average Molecular Weight156.2652
Monoisotopic Molecular Weight156.151415262
Classification
ClassificationNot classified
Ontology
Disposition

Route of exposure:

Biological location:

Source:

Process

Naturally occurring process:

Role

Industrial application:

Biological role:

Physico-Chemical Properties - Experimental
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateNot Available
Physical DescriptionNot Available
Mass CompositionC 76.86%; H 12.90%; O 10.24%DFC
Melting PointNot Available
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
DensityNot Available
Refractive IndexNot Available
Spectra
Spectra
Spectrum TypeDescriptionSplash Key
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positivesplash10-0a4i-9200000000-0328cf5b09222f710cb3View in MoNA
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (1 TMS) - 70eV, Positivesplash10-01qi-9620000000-55b1d5a76f67f5051e49View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-052r-1900000000-1280c251635b19021ed3View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-052k-9600000000-77cee19a7027720fcea3View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0a59-9200000000-d9945a1290f2ac0d3129View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0a4i-0900000000-f6069eab4add4d4fdeb4View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0a4j-4900000000-7f7afd1f9b3a65c01617View in MoNA
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-0002-9400000000-01d7abacc51972b908d8View in MoNA
ChemSpider ID9926
ChEMBL IDNot Available
KEGG Compound IDNot Available
Pubchem Compound ID10353
Pubchem Substance IDNot Available
ChEBI IDNot Available
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB34717
CRC / DFC (Dictionary of Food Compounds) IDHQF87-I:HQF87-I
EAFUS IDNot Available
Dr. Duke IDNot Available
BIGG IDNot Available
KNApSAcK IDC00010899
HET IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDrw1006311
SuperScent IDNot Available
Wikipedia IDNot Available
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
Flavours
FlavorCitations
sweet
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
pine
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
terpenic
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
lime
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
woody
  1. The Good Scents Company (2009). Flavor and fragrance information catalog. <http://www.thegoodscentscompany.com/allprod.html> Accessed 15.10.23.
Files
MSDSNot Available
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference— Shinbo, Y., et al. 'KNApSAcK: a comprehensive species-metabolite relationship database.' Plant Metabolomics. Springer Berlin Heidelberg, 2006. 165-181.