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2-Ethylbutyric acid

View entire compound with spectra: 32 NMR, 10 FTIR, 1 Raman, 18 MS (GC), and 2 Near IR

2-Ethylbutyric acid
SpectraBase Compound ID J3NW6CAyiXT
InChI InChI=1S/C6H12O2/c1-3-5(4-2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey OXQGTIUCKGYOAA-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

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SpectraBase Spectrum ID 8uZIuY1fWtp
Name 2-Ethyl-butanoic acid
CAS Registry Number 88-09-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H12O2
InChI InChI=1S/C6H12O2/c1-3-5(4-2)6(7)8/h5H,3-4H2,1-2H3,(H,7,8)
InChIKey OXQGTIUCKGYOAA-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference P.A. Couperus, A.D. Clague, Org. Magn. Resonance 11, 590 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3