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2-Butenedioic acid, 2,3-bis[(4-bromophenyl)amino]-, dimethyl ester
SpectraBase Compound ID 37BdlOSRxVG
InChI InChI=1S/C18H16Br2N2O4/c1-25-17(23)15(21-13-7-3-11(19)4-8-13)16(18(24)26-2)22-14-9-5-12(20)6-10-14/h3-10,21-22H,1-2H3/b16-15+
InChIKey IBMVQZWYQQUNNC-FOCLMDBBSA-N
Mol Weight 484.14 g/mol
Molecular Formula C18H16Br2N2O4
Exact Mass 481.947683 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1jnEIpI7wmT
Name 2-Butenedioic acid, 2,3-bis[(4-bromophenyl)amino]-, dimethyl ester
Alternate Name(s) Dimethyl 2,3-bis((4-bromophenyl)amino)fumarate 2,3-bis(4-bromoanilino)-2-butenedioic acid dimethyl ester Dimethyl 2,3-bis(4-bromoanilino)but-2-enedioate Dimethyl 2,3-bis[(4-bromophenyl)amino]but-2-enedioate
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Formula C18H16Br2N2O4
InChI InChI=1S/C18H16Br2N2O4/c1-25-17(23)15(21-13-7-3-11(19)4-8-13)16(18(24)26-2)22-14-9-5-12(20)6-10-14/h3-10,21-22H,1-2H3/b16-15+
InChIKey IBMVQZWYQQUNNC-FOCLMDBBSA-N
Molecular Weight 484.144 g/mol
SMILES N(\C(=C\(C(OC)=O)Nc1ccc(Br)cc1)C(=O)OC)c1ccc(Br)cc1
SPLASH splash10-001i-0656900000-215aeb38dfee1b7df76c
Source of Spectrum JX-2015-4-858
Wiley ID 1726273