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2,12-Diphenyl-3,20 : 10, 13-di(epi)-thio-6,9 ; 16, 19-diimino-1,11-diaza[20]annulene
SpectraBase Compound ID LbMYRBhPZiA
InChI InChI=1S/C30H20N4S2/c1-3-7-19(8-4-1)27-25-17-13-21-12-16-24(32-21)30-34-28(20-9-5-2-6-10-20)26(36-30)18-14-22-11-15-23(31-22)29(33-27)35-25/h1-18,31-32H/b17-13-,18-14-,21-13-,22-14-,25-17-,26-18-,29-23-,30-24-
InChIKey GFCKDGQZLRDEME-QEZBKNEQSA-N
Mol Weight 500.64 g/mol
Molecular Formula C30H20N4S2
Exact Mass 500.112939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1ZcwYK9lrAD
Name 2,12-Diphenyl-3,20 : 10, 13-di(epi)-thio-6,9 ; 16, 19-diimino-1,11-diaza[20]annulene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H20N4S2
InChI InChI=1S/C30H20N4S2/c1-3-7-19(8-4-1)27-25-17-13-21-12-16-24(32-21)30-34-28(20-9-5-2-6-10-20)26(36-30)18-14-22-11-15-23(31-22)29(33-27)35-25/h1-18,31-32H/b17-13-,18-14-,21-13-,22-14-,25-17-,26-18-,29-23-,30-24-
InChIKey GFCKDGQZLRDEME-QEZBKNEQSA-N
Molecular Weight 500.638 g/mol
SMILES [nH]1c2\C=C/c3c(nc(-c4ccc(\C=C/c5c(nc(-c1cc2)s5)-c1ccccc1)[nH]4)s3)-c1ccccc1
SPLASH splash10-0udi-0200190000-2ee02c0350a393e80edd
Source of Spectrum K1-2000-2456-9
Synonyms 4,14-diphenyl-22,24-dithia-3,13,21,23-tetraazapentacyclo[16.2.1.1(2,5).1(8,11).1(12,15)]tetracosa-1(20),2,4,6,8,10,12,14,16,18-decaene
Wiley ID 750057