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

*Links on SpectraBase are not permalinks.
cis-Aconitic acid
SpectraBase Compound ID GATRc7ZoLhj
InChI InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1-
InChIKey GTZCVFVGUGFEME-IWQZZHSRSA-N
Mol Weight 174.11 g/mol
Molecular Formula C6H6O6
Exact Mass 174.016438 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 CENpDUBWuJP
Name 1-PROPENE-1,2,3-TRICARBOXYLIC ACID
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C6H6O6
InChI InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/b3-1-
InChIKey GTZCVFVGUGFEME-IWQZZHSRSA-N
Molecular Weight 174.0162
SMILES OC(\C=C\(CC(O)=O)C(=O)O)=O
SPLASH splash10-0016-9100000000-f0659d74462b3a809536
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany