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5-{2-[2-(p-bromophenyl)-indol-3-yl]-ethenyl}(3-methyl-4-amino)isoxazole
SpectraBase Compound ID CtGarthOWo6
InChI InChI=1S/C20H16BrN3O/c1-12-19(22)18(25-24-12)11-10-16-15-4-2-3-5-17(15)23-20(16)13-6-8-14(21)9-7-13/h2-11,23H,22H2,1H3/b11-10+
InChIKey JCQOMXPGTHYLMZ-ZHACJKMWSA-N
Mol Weight 394.27 g/mol
Molecular Formula C20H16BrN3O
Exact Mass 393.047675 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CGgR6V4ljsB
Name 5-{2-[2-(p-bromophenyl)-indol-3-yl]-ethenyl}(3-methyl-4-amino)isoxazole
Alternate Name(s) 5-{(E)-2-[2-(4-bromophenyl)-1H-indol-3-yl]ethenyl}-3-methyl-4-isoxazolamine 5-{(E)-2-[2-(4-bromophenyl)-1H-indol-3-yl]ethenyl}-3-methyl-4-isoxazolylamine
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Formula C20H16BrN3O
InChI InChI=1S/C20H16BrN3O/c1-12-19(22)18(25-24-12)11-10-16-15-4-2-3-5-17(15)23-20(16)13-6-8-14(21)9-7-13/h2-11,23H,22H2,1H3/b11-10+
InChIKey JCQOMXPGTHYLMZ-ZHACJKMWSA-N
Molecular Weight 394.272 g/mol
SMILES Nc1c(\C=C\c2c([nH]c3ccccc23)-c2ccc(cc2)Br)onc1C
SPLASH splash10-00xv-0039000000-42b0ca6d4d504067397b
Source of Spectrum O-27-901-0
Wiley ID 1366223