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2-Acetyl-4-pentenoic acid prop-2-ynyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Acetyl-4-pentenoic acid prop-2-ynyl ester
SpectraBase Compound ID U5ZB3hLvTS
InChI InChI=1S/C10H12O3/c1-4-6-9(8(3)11)10(12)13-7-5-2/h2,4,9H,1,6-7H2,3H3
InChIKey AYFRYTBLRWZTNG-UHFFFAOYSA-N
Mol Weight 180.2 g/mol
Molecular Formula C10H12O3
Exact Mass 180.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZUUo57xAg0
Name 2-Acetyl-4-pentenoic acid prop-2-ynyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O3
InChI InChI=1S/C10H12O3/c1-4-6-9(8(3)11)10(12)13-7-5-2/h2,4,9H,1,6-7H2,3H3
InChIKey AYFRYTBLRWZTNG-UHFFFAOYSA-N
Molecular Weight 180.203 g/mol
SMILES C(C(C(C)=O)CC=C)(=O)OCC#C
SPLASH splash10-000f-9000000000-12aa85ee2b2d073052cd
Source of Spectrum J-64-1381-3
Synonyms 2-Acetylpent-4-enoic acid propargyl ester Prop-2-ynyl 2-acetylpent-4-enoate Prop-2-ynyl 2-ethanoylpent-4-enoate
Wiley ID 1529443