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1,4-Cyclohexadiene-1-carboxylic acid

View entire compound with spectra: 1 MS (GC)

1,4-Cyclohexadiene-1-carboxylic acid
SpectraBase Compound ID 2ekXr2K8nic
InChI InChI=1S/C7H8O2/c8-7(9)6-4-2-1-3-5-6/h1-2,5H,3-4H2,(H,8,9)
InChIKey XCSQXCKDEVRTHN-UHFFFAOYSA-N
Mol Weight 124.14 g/mol
Molecular Formula C7H8O2
Exact Mass 124.052429 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3U4ePoYmQ4
Name 1,4-Cyclohexadiene-1-carboxylic acid
CAS Registry Number 4315-35-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O2
InChI InChI=1S/C7H8O2/c8-7(9)6-4-2-1-3-5-6/h1-2,5H,3-4H2,(H,8,9)
InChIKey XCSQXCKDEVRTHN-UHFFFAOYSA-N
Molecular Weight 124.139 g/mol
SMILES OC(C=1CC=CCC1)=O
SPLASH splash10-004i-9200000000-b446edf6d5176902241f
Synonyms 1-cyclohexa-1,4-dienecarboxylic acid cyclohexa-1,4-diene-1-carboxylic acid Cyclohexa-1,4-dienecarboxylic acid
Wiley ID 1454218