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(1E)-1-Methyl-3-oxo-1-butenyl acetate
SpectraBase Compound ID CNemThYpyp2
InChI InChI=1S/C7H10O3/c1-5(8)4-6(2)10-7(3)9/h4H,1-3H3/b6-4+
InChIKey LBQVXEZJUOFPFA-GQCTYLIASA-N
Mol Weight 142.15 g/mol
Molecular Formula C7H10O3
Exact Mass 142.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BLL5e8ioPeK
Name (1E)-1-Methyl-3-oxo-1-butenyl acetate
Alternate Name(s) Acetic acid, 1-methyl-3-oxo-but-1-enyl ester 3-Penten-2-one, 4-(acetyloxy)-, (Z)- Acetic acid [(E)-4-oxopent-2-en-2-yl] ester [(E)-4-oxopent-2-en-2-yl] acetate [(E)-1-methyl-3-oxo-but-1-enyl] acetate [(E)-4-oxidanylidenepent-2-en-2-yl] ethanoate
CAS Registry Number 38365-58-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H10O3
InChI InChI=1S/C7H10O3/c1-5(8)4-6(2)10-7(3)9/h4H,1-3H3/b6-4+
InChIKey LBQVXEZJUOFPFA-GQCTYLIASA-N
Molecular Weight 142.154 g/mol
SMILES CC(=O)O\C(C)=C/C(=O)C
SPLASH splash10-0006-9100000000-7ca75928978e93bbdc51
Wiley ID 1497260