Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 01:11:43 UTC
Update Date2022-08-31 06:28:23 UTC
Metabolite IDMMDBc0008298
Metabolite Identification
Common Name4'-(4,5-dimethyl-1,3-dioxolan-2-yl)methyl-phenol
Description4'-(4,5-dimethyl-1,3-dioxolan-2-yl)methyl-phenol belongs to the class of organic compounds known as 1-hydroxy-2-unsubstituted benzenoids. These are phenols that are unsubstituted at the 2-position. Based on a literature review very few articles have been published on 4'-(4,5-dimethyl-1,3-dioxolan-2-yl)methyl-phenol.
Structure
SynonymsNot Available
Molecular FormulaC12H16O3
Average Mass208.257
Monoisotopic Mass208.109944375
IUPAC Name4-{[(4S,5S)-4,5-dimethyl-1,3-dioxolan-2-yl]methyl}phenol
Traditional Name4-{[(4S,5S)-4,5-dimethyl-1,3-dioxolan-2-yl]methyl}phenol
CAS Registry NumberNot Available
SMILES
[H][C@@]1(C)OC(CC2=CC=C(O)C=C2)O[C@@]1([H])C
InChI Identifier
InChI=1S/C12H16O3/c1-8-9(2)15-12(14-8)7-10-3-5-11(13)6-4-10/h3-6,8-9,12-13H,7H2,1-2H3/t8-,9-/m0/s1
InChI KeyLZNLGTWGIXTYMF-IUCAKERBSA-N