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Ethyl 6-oxoheptanoate
SpectraBase Compound ID KSW0B3K7bQS
InChI InChI=1S/C9H16O3/c1-3-12-9(11)7-5-4-6-8(2)10/h3-7H2,1-2H3
InChIKey OUHHAOKXQRZRSY-UHFFFAOYSA-N
Mol Weight 172.22 g/mol
Molecular Formula C9H16O3
Exact Mass 172.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID M7sw82w7s
Name Ethyl 6-oxoheptanoate
CAS Registry Number 30956-41-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O3
InChI InChI=1S/C9H16O3/c1-3-12-9(11)7-5-4-6-8(2)10/h3-7H2,1-2H3
InChIKey OUHHAOKXQRZRSY-UHFFFAOYSA-N
Molecular Weight 172.224 g/mol
SMILES C(=O)(OCC)CCCCC(=O)C
SPLASH splash10-0ab9-9200000000-a7d77721b0581ba6dd34
Source of Spectrum QB-17-383-15
Synonyms Heptanoic acid, 6-oxo-, ethyl ester 6-ketoenanthic acid ethyl ester 6-Oxoheptanoic acid ethyl ester Ethyl 6-oxidanylideneheptanoate
Wiley ID 841672