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6-(E)-Benzylimino-1,4,5-triphenyl-1,6-dihydro-2H-pyridazine-3-thione
SpectraBase Compound ID 7Pz1QKISmOE
InChI InChI=1S/C29H23N3S/c33-29-27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)28(30-21-22-13-5-1-6-14-22)32(31-29)25-19-11-4-12-20-25/h1-20H,21H2,(H,31,33)/b30-28+
InChIKey LQTRBXJWVNCDAO-SJCQXOIGSA-N
Mol Weight 445.58 g/mol
Molecular Formula C29H23N3S
Exact Mass 445.161269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F2vik1Grk6j
Name 6-(E)-Benzylimino-1,4,5-triphenyl-1,6-dihydro-2H-pyridazine-3-thione
Appearance Yellow crystals
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Formula C29H23N3S
InChI InChI=1S/C29H23N3S/c33-29-27(24-17-9-3-10-18-24)26(23-15-7-2-8-16-23)28(30-21-22-13-5-1-6-14-22)32(31-29)25-19-11-4-12-20-25/h1-20H,21H2,(H,31,33)/b30-28+
InChIKey LQTRBXJWVNCDAO-SJCQXOIGSA-N
Instrument Name Finnigan MAT 8430
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.e01
Molecular Weight 445.584 g/mol
SMILES N1N(\C(C(=C(C1=S)c1ccccc1)c1ccccc1)=N/Cc1ccccc1)c1ccccc1
SPLASH splash10-05mp-9212300000-51dab22cfe6963986337
Source of Spectrum ARK-2007-9-5e
Wiley ID 1868874