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3,20 : 10, 13-di(epi)-Thio-6,9 ; 16, 19-diimino-1,11-diaza[20]annulene
SpectraBase Compound ID 7sPUOWmL09v
InChI InChI=1S/C18H12N4S2/c1-5-13-9-19-18(23-13)16-8-4-12(22-16)2-6-14-10-20-17(24-14)15-7-3-11(1)21-15/h1-10,21-22H/b5-1-,6-2-,11-1-,12-2-,13-5-,14-6-,17-15-,18-16-
InChIKey PEVLVLKCTKPKQJ-VOHRKHSRSA-N
Mol Weight 348.44 g/mol
Molecular Formula C18H12N4S2
Exact Mass 348.050339 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8v6QDRgVvbu
Name 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 C18H12N4S2
InChI InChI=1S/C18H12N4S2/c1-5-13-9-19-18(23-13)16-8-4-12(22-16)2-6-14-10-20-17(24-14)15-7-3-11(1)21-15/h1-10,21-22H/b5-1-,6-2-,11-1-,12-2-,13-5-,14-6-,17-15-,18-16-
InChIKey PEVLVLKCTKPKQJ-VOHRKHSRSA-N
Molecular Weight 348.442 g/mol
SMILES [nH]1c2\C=C/c3sc(-c4ccc(\C=C/c5cnc(-c1cc2)s5)[nH]4)nc3
SPLASH splash10-0002-0409000000-b8cff62412c2a4a1ac10
Source of Spectrum K1-2000-2455-9
Synonyms 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 3,20 ; 10,13-Diepithio-6',9' : 16',19-diiminodiaza[20]annulene
Wiley ID 814708