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4-(2-Bromo-phenyl)-2-methyl-buta-2,3-dienoic acid p-tolylamide
SpectraBase Compound ID ImqKg2Csub0
InChI InChI=1S/C18H16BrNO/c1-13-7-11-16(12-8-13)20-18(21)14(2)9-10-15-5-3-4-6-17(15)19/h3-8,10-12H,1-2H3,(H,20,21)
InChIKey AXXBWBRVYGBEGD-UHFFFAOYSA-N
Mol Weight 342.24 g/mol
Molecular Formula C18H16BrNO
Exact Mass 341.041527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9u3IZ8DsxjB
Name 4-(2-Bromo-phenyl)-2-methyl-buta-2,3-dienoic acid p-tolylamide
Alternate Name(s) 4-(2-bromophenyl)-2-methyl-N-(p-tolyl)buta-2,3-dienamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16BrNO
InChI InChI=1S/C18H16BrNO/c1-13-7-11-16(12-8-13)20-18(21)14(2)9-10-15-5-3-4-6-17(15)19/h3-8,10-12H,1-2H3,(H,20,21)
InChIKey AXXBWBRVYGBEGD-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol3018775
Molecular Weight 342.236 g/mol
SMILES N(C(C(C)=C=Cc1ccccc1Br)=O)c1ccc(cc1)C
SPLASH splash10-03di-0291000000-53d296e44c7ddc1fcdfa
Source of Spectrum A1-14-4398/SMS6-1h
Wiley ID 1750521