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 BaFdxdOV32M
Name Trimethoxybenzoic acid ME @
CAS Registry Number 1916-07-0
Classification Antihypertensive Neuroleptic
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 226.084123546 u
Formula C11H14O5
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
Ionization Type Electron Ionization (EI)
Molecular Weight 226.228 g/mol
SMILES c1c(cc(OC)c(c1OC)OC)C(OC)=O
SPLASH splash10-004i-5980000000-ada19eccd57fd7b2a5d3
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Dilazep-M/artifact (trimethoxybenzoic acid) ME Hexobendine-M/artifact (trimethoxybenzoic acid) ME Metofenazate-M/artifact (trimethoxybenzoic acid) ME Reserpine-M (trimethoxybenzoic acid) ME Trimebutine-M (TMBA) ME
Technique GC/MS
Wiley ID MMPW6e_1950