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

*Links on SpectraBase are not permalinks.
3,4,5-Trimethoxybenzoic acid methyl ester
SpectraBase Compound ID HElJKNMbA8r
InChI InChI=1S/C11H14O5/c1-13-8-5-7(11(12)16-4)6-9(14-2)10(8)15-3/h5-6H,1-4H3
InChIKey KACHFMOHOPLTNX-UHFFFAOYSA-N
Mol Weight 226.23 g/mol
Molecular Formula C11H14O5
Exact Mass 226.084124 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 JKvgroPORR7
Name Methyl eudesmate
CAS Registry Number 1916-07-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O5
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/C11H14O5/c1-13-8-5-7(11(12)16-4)6-9(14-2)10(8)15-3/h5-6H,1-4H3
InChIKey KACHFMOHOPLTNX-UHFFFAOYSA-N
Molecular Weight 226.228 g/mol
SMILES COc1c(OC)cc(cc1OC)C(OC)=O
SPLASH splash10-004i-6980000000-01f3582696532b3c0b51
Source ex IAN SOUTHWELL
Source of Spectrum Adams' Essential Oil Components (GC-MS), Version 4
Wiley ID 1886705