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Methyl 5-oxoheptanoate
SpectraBase Compound ID DTjvDUTm9wG
InChI InChI=1S/C8H14O3/c1-3-7(9)5-4-6-8(10)11-2/h3-6H2,1-2H3
InChIKey HIMIBFCIVOXHAY-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 4F8rxaJPa1r
Name Methyl 5-oxoheptanoate
Alternate Name(s) 5-ketoenanthic acid methyl ester 5-Oxoheptanoic acid methyl ester Methyl 5-oxidanylideneheptanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-3-7(9)5-4-6-8(10)11-2/h3-6H2,1-2H3
InChIKey HIMIBFCIVOXHAY-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES C(=O)(OC)CCCC(=O)CC
SPLASH splash10-00di-9400000000-602c5ee0a28035b7a19f
Source of Spectrum J-53-1068-6
Wiley ID 1155237