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Cyclohexaneacetic acid

View entire compound with spectra: 13 NMR, 10 FTIR, 1 Raman, and 5 MS (GC)

Cyclohexaneacetic acid
SpectraBase Compound ID 7paH27J5VE2
InChI InChI=1S/C8H14O2/c9-8(10)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)
InChIKey LJOODBDWMQKMFB-UHFFFAOYSA-N
Mol Weight 142.2 g/mol
Molecular Formula C8H14O2
Exact Mass 142.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4evJNbSxLRv
Name Cyclohexaneacetic acid
Alternate Name(s) 2-Cyclohexylacetic acid Cyclohexylacetic acid 2-Cyclohexylethanoic acid Cyclohexylethanoic acid Hexahydrophenylacetic acid AI3-14243 BRN 2041326 EINECS 226-132-0 FEMA NO. 2347 NSC 2159
CAS Registry Number 5292-21-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O2
InChI InChI=1S/C8H14O2/c9-8(10)6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)
InChIKey LJOODBDWMQKMFB-UHFFFAOYSA-N
Molecular Weight 142.198 g/mol
SMILES OC(CC1CCCCC1)=O
SPLASH splash10-01q9-9000000000-2dd81b07904f2a06b0bd
Source of Spectrum JX-2015-6-3834
Wiley ID 1728683