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3-Benzoyl-3-butenoic acid methyl ester
SpectraBase Compound ID BOxLQJERXr5
InChI InChI=1S/C12H12O3/c1-9(8-11(13)15-2)12(14)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3
InChIKey MMAJXVJTOBNDCQ-UHFFFAOYSA-N
Mol Weight 204.22 g/mol
Molecular Formula C12H12O3
Exact Mass 204.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KsOikAtvKJb
Name 3-Benzoyl-3-butenoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3
InChI InChI=1S/C12H12O3/c1-9(8-11(13)15-2)12(14)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3
InChIKey MMAJXVJTOBNDCQ-UHFFFAOYSA-N
Molecular Weight 204.225 g/mol
SMILES C(C(=O)c1ccccc1)(CC(=O)OC)=C
SPLASH splash10-0a6r-6910000000-3a498bb078a09f570f04
Source of Spectrum J-59-3209-19
Synonyms 3-Benzoylbut-3-enoic acid methyl ester Methyl 3-(phenylcarbonyl)but-3-enoate Methyl 3-benzoyl-3-butenoate Methyl 3-benzoylbut-3-enoate
Wiley ID 1201857