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2-Ethyl-3-oxohexanoic acid
SpectraBase Compound ID J6N97QsEOAR
InChI InChI=1S/C8H14O3/c1-3-5-7(9)6(4-2)8(10)11/h6H,3-5H2,1-2H3,(H,10,11)
InChIKey DKHKWOWKZHBBGV-UHFFFAOYSA-N
Mol Weight 158.2 g/mol
Molecular Formula C8H14O3
Exact Mass 158.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 291K879fxgh
Name 2-Ethyl-3-oxohexanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-3-5-7(9)6(4-2)8(10)11/h6H,3-5H2,1-2H3,(H,10,11)
InChIKey DKHKWOWKZHBBGV-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES OC(C(C(=O)CCC)CC)=O
SPLASH splash10-00dl-9100000000-4b53849122ce2f9dd991
Source of Spectrum LQ-1992-4068-0
Synonyms 2-Ethyl-3-keto-hexanoic acid 2-Ethyl-3-oxidanylidene-hexanoic acid
Wiley ID 1155220