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2-Ethyl-5-methyl-hexanoic acid
SpectraBase Compound ID EcaZmXCpEld
InChI InChI=1S/C9H18O2/c1-4-8(9(10)11)6-5-7(2)3/h7-8H,4-6H2,1-3H3,(H,10,11)
InChIKey MAQIPNRKAZZHBJ-UHFFFAOYSA-N
Mol Weight 158.24 g/mol
Molecular Formula C9H18O2
Exact Mass 158.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7Hcva7OgjLr
Name 2-Ethyl-5-methyl-hexanoic acid
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H18O2
InChI InChI=1S/C9H18O2/c1-4-8(9(10)11)6-5-7(2)3/h7-8H,4-6H2,1-3H3,(H,10,11)
InChIKey MAQIPNRKAZZHBJ-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference D.H. Marr, Org. Magn. Resonance 13, 29 (1980).
NMR Standard TMS Ext.
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Neat liquid