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N-(4-Methylphenyl)-3,7,4,8-tetraphenyl-2,6-Imino-2H,6H-1,5-dithiocine
SpectraBase Compound ID GBQ1q8cuahy
InChI InChI=1S/C37H29NS2/c1-26-22-24-31(25-23-26)38-36-32(27-14-6-2-7-15-27)34(29-18-10-4-11-19-29)39-37(38)33(28-16-8-3-9-17-28)35(40-36)30-20-12-5-13-21-30/h2-25,36-37H,1H3/t36-,37-/m0/s1
InChIKey VZMUDONINCFMJU-BCRBLDSWSA-N
Mol Weight 551.8 g/mol
Molecular Formula C37H29NS2
Exact Mass 551.174142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9AEnZf9vCsA
Name N-(4-Methylphenyl)-3,7,4,8-tetraphenyl-2,6-Imino-2H,6H-1,5-dithiocine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H29NS2
InChI InChI=1S/C37H29NS2/c1-26-22-24-31(25-23-26)38-36-32(27-14-6-2-7-15-27)34(29-18-10-4-11-19-29)39-37(38)33(28-16-8-3-9-17-28)35(40-36)30-20-12-5-13-21-30/h2-25,36-37H,1H3/t36-,37-/m0/s1
InChIKey VZMUDONINCFMJU-BCRBLDSWSA-N
Molecular Weight 551.766 g/mol
SMILES [C@]12(N([C@](C(=C(S2)c2ccccc2)c2ccccc2)(SC(=C1c1ccccc1)c1ccccc1)[H])c1ccc(cc1)C)[H]
SPLASH splash10-03dl-0590300000-5b0a8ace45652b3c0253
Source of Spectrum SO-0-790-3
Wiley ID 876690