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9,18-Dithia-2,3-diazatricyclo[18.2.2.24,7]hexacosa-2,4,6,20,22,23,25-heptaene, (E)-
SpectraBase Compound ID 41Lm8MfPYGT
InChI InChI=1S/C22H28N2S2/c1-2-4-6-16-26-18-20-9-13-22(14-10-20)24-23-21-11-7-19(8-12-21)17-25-15-5-3-1/h7-14H,1-6,15-18H2/b24-23-
InChIKey OSXGECWKKBRHJD-VHXPQNKSSA-N
Mol Weight 384.6 g/mol
Molecular Formula C22H28N2S2
Exact Mass 384.169391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0kL0ghgVYt
Name 9,18-Dithia-2,3-diazatricyclo[18.2.2.24,7]hexacosa-2,4,6,20,22,23,25-heptaene, (E)-
CAS Registry Number 114038-82-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2S2
InChI InChI=1S/C22H28N2S2/c1-2-4-6-16-26-18-20-9-13-22(14-10-20)24-23-21-11-7-19(8-12-21)17-25-15-5-3-1/h7-14H,1-6,15-18H2/b24-23-
InChIKey OSXGECWKKBRHJD-VHXPQNKSSA-N
Molecular Weight 384.600 g/mol
SMILES c12\N=N/c3ccc(CSCCCCCCCCSCc(cc2)cc1)cc3
SPLASH splash10-001l-9836000000-d37b553d96dae247470b
Source of Spectrum F-43-3794-3
Synonyms 2,11-Dithia-19,20-diaza(12,2)paracyclophane-19-ene 2,11-Dithia-19,20-diaza[12.2]paracyclophane-19-ene 9,18-dithia-2,3-diazatricyclo[18.2.2.2(4,7)]hexacosa-1(22),2,4,6,20,23,25-heptaene
Wiley ID 1361696