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4-ketovaleric acid propyl ester
SpectraBase Compound ID D5R4szfDiXZ
InChI InChI=1S/C8H14O3/c1-3-6-11-8(10)5-4-7(2)9/h3-6H2,1-2H3
InChIKey QOSMNYMQXIVWKY-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 3qD0qPsVL5D
Name 4-ketovaleric acid propyl ester
Alternate Name(s) Propyl 4-oxopentanoate n-Propyl levulinate 4-Oxopentanoic acid propyl ester Pentanoic acid, 4-oxo-, propyl ester Propyl 4-oxidanylidenepentanoate
CAS Registry Number 645-67-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H14O3
InChI InChI=1S/C8H14O3/c1-3-6-11-8(10)5-4-7(2)9/h3-6H2,1-2H3
InChIKey QOSMNYMQXIVWKY-UHFFFAOYSA-N
Molecular Weight 158.197 g/mol
SMILES C(=O)(CCC(=O)C)OCCC
SPLASH splash10-0006-9100000000-d7f8b67ea8833f21b0ca
Source of Spectrum LQ-1992-1570-0
Wiley ID 1155218