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2,11-dithia-19,20-diaza-[3.3.2[(1,3)(1,4)(1,4)cyclophan-19-ene
SpectraBase Compound ID 2aYHF1EMLzP
InChI InChI=1S/C22H20N2S2/c1-2-19-12-20(3-1)16-26-14-18-6-10-22(11-7-18)24-23-21-8-4-17(5-9-21)13-25-15-19/h1-12H,13-16H2/b24-23-
InChIKey ZDILCPDZMLTJCW-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 EcWGumY1QgN
Name 2,11-dithia-19,20-diaza-[3.3.2[(1,3)(1,4)(1,4)cyclophan-19-ene
CAS Registry Number 125686-42-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20N2S2
InChI InChI=1S/C22H20N2S2/c1-2-19-12-20(3-1)16-26-14-18-6-10-22(11-7-18)24-23-21-8-4-17(5-9-21)13-25-15-19/h1-12H,13-16H2/b24-23-
InChIKey ZDILCPDZMLTJCW-VHXPQNKSSA-N
Molecular Weight 376.536 g/mol
SMILES c12\N=N/c3ccc(CSCc4cccc(CSCc(cc2)cc1)c4)cc3
SPLASH splash10-002f-3912000000-cf17da6c9665082514c6
Source of Spectrum K-123-1401-13
Synonyms 9,17-dithia-2,3-diazatetracyclo[17.2.2.2(4,7).1(11,15)]hexacosa-1(21),2,4,6,11(26),12,14,19,22,24-decaene
Wiley ID 1357825