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

*Links on SpectraBase are not permalinks.
cyclohepta-1,3,5-triene-1-carboxylic acid
SpectraBase Compound ID 6BruN1DJOvS
InChI InChI=1S/C8H8O2/c9-8(10)7-5-3-1-2-4-6-7/h1-5H,6H2,(H,9,10)
InChIKey KXSMZMFEFFBOAL-UHFFFAOYSA-N
Mol Weight 136.15 g/mol
Molecular Formula C8H8O2
Exact Mass 136.052429 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 7qNl28LvB7C
Name 1-cyclohepta-1,3,5-trienecarboxylic acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H8O2
InChI InChI=1S/C8H8O2/c9-8(10)7-5-3-1-2-4-6-7/h1-5H,6H2,(H,9,10)
InChIKey KXSMZMFEFFBOAL-UHFFFAOYSA-N
Molecular Weight 136.150 g/mol
SMILES OC(C1=CC=CC=CC1)=O
SPLASH splash10-0006-9100000000-b7d244fb146772e1caa4
Source of Spectrum AJ-66-278-10
Synonyms cyclohepta-1,3,5-triene-1-carboxylic acid
Wiley ID 771947