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2-Methylhexanoic acid

View entire compound with spectra: 22 NMR, 4 FTIR, 1 Raman, and 9 MS (GC)

2-Methylhexanoic acid
SpectraBase Compound ID LLNicmX8Ehd
InChI InChI=1S/C7H14O2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
InChIKey CVKMFSAVYPAZTQ-UHFFFAOYSA-N
Mol Weight 130.19 g/mol
Molecular Formula C7H14O2
Exact Mass 130.09938 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CUfTMYykC9o
Name 2-METHYLHEXANOIC ACID
Source of Sample Fluka AG, Buchs, Switzerland
Boiling Point 210-212C
CAS Registry Number 4536-23-6
Comments Impurities
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O2
InChI InChI=1S/C7H14O2/c1-3-4-5-6(2)7(8)9/h6H,3-5H2,1-2H3,(H,8,9)
InChIKey CVKMFSAVYPAZTQ-UHFFFAOYSA-N
Molecular Weight 130.19
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms HEXANOIC ACID, 2-METHYL-,