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Pentanoic acid, 3,5-dioxo-, methyl ester
SpectraBase Compound ID 2ohLukP2xpK
InChI InChI=1S/C6H8O4/c1-10-6(9)4-5(8)2-3-7/h3H,2,4H2,1H3
InChIKey NZOZKLSVSHBECX-UHFFFAOYSA-N
Mol Weight 144.13 g/mol
Molecular Formula C6H8O4
Exact Mass 144.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HCQsvKKUWiE
Name Pentanoic acid, 3,5-dioxo-, methyl ester
Alternate Name(s) 3,5-Diketovaleric acid methyl ester 3,5-Dioxopentanoic acid methyl ester Methyl 3,5-bis(oxidanylidene)pentanoate Methyl 3,5-dioxopentanoate
CAS Registry Number 36568-10-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H8O4
InChI InChI=1S/C6H8O4/c1-10-6(9)4-5(8)2-3-7/h3H,2,4H2,1H3
InChIKey NZOZKLSVSHBECX-UHFFFAOYSA-N
Molecular Weight 144.126 g/mol
SMILES C(=O)CC(CC(OC)=O)=O
SPLASH splash10-0uki-9500000000-2cb512d02b65086bd7b1
Source of Spectrum I-52-1348-11
Wiley ID 1142228