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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) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11JxvKK0Aq0
Name Hexanoic acid, 2-methyl-
CAS Registry Number 4536-23-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. 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
Instrument Name Varian CFT-20
Literature Reference A. Ejchart, Org. Magn. Resonance 15, 22 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3