For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2',3',3'-Trimethyl-2',3'-dihydroangelicin
SpectraBase Compound ID 66ClrCPgmzQ
InChI InChI=1S/C14H14O3/c1-8-14(2,3)12-10(16-8)6-4-9-5-7-11(15)17-13(9)12/h4-8H,1-3H3
InChIKey PGJWLZGSFVAXBY-UHFFFAOYSA-N
Mol Weight 230.26 g/mol
Molecular Formula C14H14O3
Exact Mass 230.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID B4dgfqtNi7c
Name 2',3',3'-Trimethyl-2',3'-dihydroangelicin
CAS Registry Number 94515-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14O3
GC Column J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness)
GC Oven Program 60 ??C to 246 ??C at 3 ??C/min.
InChI InChI=1S/C14H14O3/c1-8-14(2,3)12-10(16-8)6-4-9-5-7-11(15)17-13(9)12/h4-8H,1-3H3
InChIKey PGJWLZGSFVAXBY-UHFFFAOYSA-N
Molecular Weight 230.263 g/mol
SMILES c12c(ccc3c2OC(C=C3)=O)OC(C1(C)C)C
SPLASH splash10-014i-6790000000-e7d8a426b47106024bee
Source ex LOMATIUM NEVADENSE ex VASU DEV
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Synonyms Dihydroangelicin<2',3',3'-trimethyl-2',3'->
Wiley ID 1886251