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3-Benzylamino-7,8-diphenyl-1,2,4-triazolo[4,3-b]pyridazine-6-thione
SpectraBase Compound ID BEcwIB6hf4w
InChI InChI=1S/C24H19N5S/c30-23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-26-27-24(29(22)28-23)25-16-17-10-4-1-5-11-17/h1-15H,16H2,(H,25,27)(H,28,30)
InChIKey MNPGPJMSNRKKCZ-UHFFFAOYSA-N
Mol Weight 409.51 g/mol
Molecular Formula C24H19N5S
Exact Mass 409.136117 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3P2dLII1IIo
Name 3-Benzylamino-7,8-diphenyl-1,2,4-triazolo[4,3-b]pyridazine-6-thione
Appearance Orange crystals
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Formula C24H19N5S
InChI InChI=1S/C24H19N5S/c30-23-21(19-14-8-3-9-15-19)20(18-12-6-2-7-13-18)22-26-27-24(29(22)28-23)25-16-17-10-4-1-5-11-17/h1-15H,16H2,(H,25,27)(H,28,30)
InChIKey MNPGPJMSNRKKCZ-UHFFFAOYSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.e01
Molecular Weight 409.511 g/mol
SMILES N1C(C(=C(c2[n]1c(nn2)NCc1ccccc1)c1ccccc1)c1ccccc1)=S
SPLASH splash10-0bvi-4187900000-789a0aa61b43de71aa36
Source of Spectrum ARK-2007-8-4c
Wiley ID 1868872