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2,11-dithia-19,20-diaza-[3.3.2[(1,4)(1,4)(1,4)cyclophan-19-ene
SpectraBase Compound ID 2hpECwqRhCy
InChI InChI=1S/C22H20N2S2/c1-2-18-4-3-17(1)13-25-15-19-5-9-21(10-6-19)23-24-22-11-7-20(8-12-22)16-26-14-18/h1-12H,13-16H2/b24-23-
InChIKey YQCIKAMKKJFPNJ-VHXPQNKSSA-N
Mol Weight 376.54 g/mol
Molecular Formula C22H20N2S2
Exact Mass 376.106791 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ilvLdJaDs
Name 2,11-dithia-19,20-diaza-[3.3.2[(1,4)(1,4)(1,4)cyclophan-19-ene
CAS Registry Number 125686-41-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N2S2
InChI InChI=1S/C22H20N2S2/c1-2-18-4-3-17(1)13-25-15-19-5-9-21(10-6-19)23-24-22-11-7-20(8-12-22)16-26-14-18/h1-12H,13-16H2/b24-23-
InChIKey YQCIKAMKKJFPNJ-VHXPQNKSSA-N
Molecular Weight 376.536 g/mol
SMILES c12\N=N/c3ccc(CSCc4ccc(CSCc(cc2)cc1)cc4)cc3
SPLASH splash10-005c-2912000000-ec744555262324e6b1fa
Source of Spectrum K-123-1401-12
Synonyms 9,16-dithia-2,3-diazatetracyclo[16.2.2.2(4,7).2(11,14)]hexacosa-1(20),2,4,6,11,13,18,21,23,25-decaene
Wiley ID 1357824