precursor

Showing entry for Menthone

Identification

PhytoHub ID
PHUB000063
Name
Menthone
Synonyms
  • Menthone (L-)
CAS Number
Not Available
Average Mass
154.253
Monoisotopic Mass
154.1357652
Chemical Formula
C10H18O
IUPAC Name
(-)-menthone
InChI Key
NFLGAXVYCFJBMK-BDAKNGLRSA-N
InChI Identifier
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9+/m1/s1
SMILES
CC(C)[[email protected]@H]1CC[[email protected]@H](C)CC1=O
Structure
MOLSDFPDBSMILESInChI

Calculated Properties

Solubility (ALOGPS)
2.65e-01 g/l
LogS (ALOGPS)
-2.77
LogP (ALOGPS)
2.65
Hydrogen Acceptors
1
Hydrogen Donors
0
Rotatable Bond Count
1
Polar Surface Area
17.07
Refractivity
46.5201
Polarizability
19.024394221277838
Formal Charge
0
Physiological Charge
0
pKa (strongest basic)
-7.420780675838815
pKa (strongest acidic)
Not Available
FreewebChemaxon powered

Taxonomy

Family
Terpenoids
Class
Monoterpenoids
Sub-class
Not Available

Spectra

Record IDSourceDescriptionView
JP000248MassBankEI-B Spectrum - -, [M]+*View Spectra
JP000321MassBankEI-B Spectrum - -, [M]+*View Spectra
JP004932MassBankEI-B Spectrum - -, [M]+*View Spectra
JP005799MassBankEI-B Spectrum - -, [M]+*View Spectra
JP006595MassBankEI-B Spectrum - -, [M]+*View Spectra
JP006609MassBankEI-B Spectrum - -, [M]+*View Spectra
JP006610MassBankEI-B Spectrum - -, [M]+*View Spectra
JP006958MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007382MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007383MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007394MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007542MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007562MassBankEI-B Spectrum - -, [M]+*View Spectra
JP007933MassBankEI-B Spectrum - -, [M]+*View Spectra
JP008386MassBankEI-B Spectrum - -, [M]+*View Spectra
JP008619MassBankEI-B Spectrum - -, [M]+*View Spectra
JP010853MassBankEI-B Spectrum - -, [M]+*View Spectra
JP010856MassBankEI-B Spectrum - -, [M]+*View Spectra

Food Sources

NameGroup
PeppermintHerbs and Spices PublicationsShow

Metabolism

No metabolism information available

Back