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(E)-5-Amino-1-(((4??-bromophenyl)imino)(phenyl)methyl)-3-methyl-1H-pyrazole-4- carbonitrile
SpectraBase Compound ID ClYQCN43R2z
InChI InChI=1S/C18H14BrN5/c1-12-16(11-20)17(21)24(23-12)18(13-5-3-2-4-6-13)22-15-9-7-14(19)8-10-15/h2-10H,21H2,1H3/b22-18+
InChIKey ARFGBEYCZINTFB-RELWKKBWSA-N
Mol Weight 380.25 g/mol
Molecular Formula C18H14BrN5
Exact Mass 379.043258 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4V7DsDfWGaU
Name (E)-5-Amino-1-(((4??-bromophenyl)imino)(phenyl)methyl)-3-methyl-1H-pyrazole-4- carbonitrile
Appearance Pale yellow crystals
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Formula C18H14BrN5
InChI InChI=1S/C18H14BrN5/c1-12-16(11-20)17(21)24(23-12)18(13-5-3-2-4-6-13)22-15-9-7-14(19)8-10-15/h2-10H,21H2,1H3/b22-18+
InChIKey ARFGBEYCZINTFB-RELWKKBWSA-N
Instrument Name Finnigan Mat 8430
Ionization Type EI
Literature Reference DOI 10.24820/ark.5550190.p009.877
Molecular Weight 380.249 g/mol
SMILES Nc1[n](\C(=N\c2ccc(cc2)Br)c2ccccc2)nc(c1C#N)C
SPLASH splash10-0a4i-0196000000-f66e2e469fdc4fc177d6
Source of Spectrum ARK-2016-102-3o
Wiley ID 1840822