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4-keto-5-methyl-hexanoic acid methyl ester
SpectraBase Compound ID KhzjLHaQ6ba
InChI InChI=1S/C8H14O3/c1-6(2)7(9)4-5-8(10)11-3/h6H,4-5H2,1-3H3
InChIKey HQESBEBOAFJVCN-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 7kQVkeO8Vi8
Name 4-keto-5-methyl-hexanoic acid methyl ester
CAS Registry Number 34553-37-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-6(2)7(9)4-5-8(10)11-3/h6H,4-5H2,1-3H3
InChIKey HQESBEBOAFJVCN-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES C(=O)(CCC(=O)C(C)C)OC
SPLASH splash10-066u-9700000000-c9d6bb9d08a803ce2fec
Source of Spectrum EP-6644-0-0
Synonyms 5-Methyl-4-oxohexanoic acid methyl ester Methyl 5-methyl-4-oxidanylidene-hexanoate Methyl 5-methyl-4-oxo-hexanoate
Wiley ID 1155144