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

*Links on SpectraBase are not permalinks.

Caproic acid

View entire compound with spectra: 47 NMR, 22 FTIR, 2 Raman, 31 MS (GC), and 2 Near IR

Caproic acid
SpectraBase Compound ID 3JrFFcFwgRv
InChI InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)
InChIKey FUZZWVXGSFPDMH-UHFFFAOYSA-N
Mol Weight 116.16 g/mol
Molecular Formula C6H12O2
Exact Mass 116.08373 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID GwLhAAuludp
Name HEXANOIC-ACID
Compound Number A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H,7,8)
InChIKey FUZZWVXGSFPDMH-UHFFFAOYSA-N
Literature Reference Author N.C.J.E.CHESTERS,D.O'HAGAN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,827(1997)
Literature Reference DOI 10.1039/a606589i
Molecular Weight 116.160 g/mol
Solvent CDCl3
Source File Reference UWRU11205