For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(E)-2-(3-bromo-4-methyl-anilino)-4-keto-4-phenyl-but-2-enoic acid
SpectraBase Compound ID DsIlBRpWPIh
InChI InChI=1S/C17H14BrNO3/c1-11-7-8-13(9-14(11)18)19-15(17(21)22)10-16(20)12-5-3-2-4-6-12/h2-10,19H,1H3,(H,21,22)/b15-10+
InChIKey GFGAGWFQMWVVMU-XNTDXEJSSA-N
Mol Weight 360.21 g/mol
Molecular Formula C17H14BrNO3
Exact Mass 359.015706 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID JTB6v772FQf
Name (E)-2-(3-bromo-4-methyl-anilino)-4-keto-4-phenyl-but-2-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14BrNO3
InChI InChI=1S/C17H14BrNO3/c1-11-7-8-13(9-14(11)18)19-15(17(21)22)10-16(20)12-5-3-2-4-6-12/h2-10,19H,1H3,(H,21,22)/b15-10+
InChIKey GFGAGWFQMWVVMU-XNTDXEJSSA-N
Molecular Weight 360.207 g/mol
SMILES OC(\C(=C/C(=O)c1ccccc1)Nc1cc(Br)c(cc1)C)=O
SPLASH splash10-02t9-2639000000-0244c77471a10ed0568c
Synonyms (E)-2-(3-bromo-4-methyl-anilino)-4-oxo-4-phenyl-but-2-enoic acid (E)-2-(3-bromo-4-methylanilino)-4-oxo-4-phenyl-2-butenoic acid (E)-2-[(3-bromanyl-4-methyl-phenyl)amino]-4-oxidanylidene-4-phenyl-but-2-enoic acid 2-(3-Bromo-4-methylanilino)-4-oxo-4-phenyl-2-butenoic acid
Wiley ID 1451358