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4-Pentenoic acid, 2-acetyl-4-methyl-, methyl ester
SpectraBase Compound ID BWSN3Z8C9I5
InChI InChI=1S/C9H14O3/c1-6(2)5-8(7(3)10)9(11)12-4/h8H,1,5H2,2-4H3
InChIKey WGZVWUIUYMGPKD-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuNWWUUU9uV
Name 4-Pentenoic acid, 2-acetyl-4-methyl-, methyl ester
CAS Registry Number 20962-71-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-6(2)5-8(7(3)10)9(11)12-4/h8H,1,5H2,2-4H3
InChIKey WGZVWUIUYMGPKD-UHFFFAOYSA-N
Molecular Weight 170.208 g/mol
SMILES C(C(CC(C)=C)C(C)=O)(OC)=O
SPLASH splash10-002f-9100000000-6582430bc3ec3423939a
Source of Spectrum EP-2736-0-0
Synonyms Methyl 2-acetyl-4-methyl-4-pentenoate 2-Acetyl-4-methyl-4-pentenoic acid methyl ester 2-Acetyl-4-methyl-pent-4-enoic acid methyl ester Methyl 2-acetyl-4-methyl-pent-4-enoate Methyl 2-ethanoyl-4-methyl-pent-4-enoate
Wiley ID 1166510