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4-(2-Chloro-phenyl)-2-methyl-buta-2,3-dienoic acid ethyl ester
SpectraBase Compound ID HVow2WvbOcC
InChI InChI=1S/C13H13ClO2/c1-3-16-13(15)10(2)8-9-11-6-4-5-7-12(11)14/h4-7,9H,3H2,1-2H3
InChIKey MVBHCGJJQGVNMF-UHFFFAOYSA-N
Mol Weight 236.7 g/mol
Molecular Formula C13H13ClO2
Exact Mass 236.060407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I9S4z3CPibv
Name 4-(2-Chloro-phenyl)-2-methyl-buta-2,3-dienoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClO2
InChI InChI=1S/C13H13ClO2/c1-3-16-13(15)10(2)8-9-11-6-4-5-7-12(11)14/h4-7,9H,3H2,1-2H3
InChIKey MVBHCGJJQGVNMF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol3018775
Molecular Weight 236.698 g/mol
SMILES c1c(c(ccc1)C=C=C(C(=O)OCC)C)Cl
SPLASH splash10-004i-0920000000-7cdbeaec9dbe8a97bfd4
Source of Spectrum A1-14-4398/SMS7-1j
Synonyms Ethyl 4-(2-chlorophenyl)-2-methylbuta-2,3-dienoate 4-(2-Chlorophenyl)-2-methylbuta-2,3-dienoic acid ethyl ester Ethyl 4-(2-chlorophenyl)-2-methyl-buta-2,3-dienoate
Wiley ID 1750523