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Pentanoic acid, 3-methyl-4-oxo-, methyl ester
SpectraBase Compound ID 8KPuJc2c1ub
InChI InChI=1S/C7H12O3/c1-5(6(2)8)4-7(9)10-3/h5H,4H2,1-3H3
InChIKey DPWCQWVJGUAQCY-UHFFFAOYSA-N
Mol Weight 144.17 g/mol
Molecular Formula C7H12O3
Exact Mass 144.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hy4UwTOq1t
Name Pentanoic acid, 3-methyl-4-oxo-, methyl ester
CAS Registry Number 25234-83-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12O3
InChI InChI=1S/C7H12O3/c1-5(6(2)8)4-7(9)10-3/h5H,4H2,1-3H3
InChIKey DPWCQWVJGUAQCY-UHFFFAOYSA-N
Molecular Weight 144.170 g/mol
SMILES C(CC(C(=O)C)C)(=O)OC
SPLASH splash10-0006-9100000000-c435491b39964e624c39
Source of Spectrum F-42-4233-20
Synonyms 3-Methyl-4-oxo-pentanoic acid methyl ester 3-Methyl-4-oxopentanoic acid methyl ester Methyl 3-methyl-4-oxopentanoate 4-keto-3-methyl-valeric acid methyl ester Methyl 3-methyl-4-oxo-pentanoate Methyl 3-methyl-4-oxidanylidene-pentanoate
Wiley ID 1142444