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9,17-Dithia-2,3-diazatricyclo[17.2.2.24,7]pentacosa-2,4,6,19,21,22,24-heptaene, (E)-
SpectraBase Compound ID 2G5AiLEkioW
InChI InChI=1S/C21H26N2S2/c1-2-4-14-24-16-18-6-10-20(11-7-18)22-23-21-12-8-19(9-13-21)17-25-15-5-3-1/h6-13H,1-5,14-17H2/b23-22-
InChIKey UGVQLVMXIAUVHL-FCQUAONHSA-N
Mol Weight 370.57 g/mol
Molecular Formula C21H26N2S2
Exact Mass 370.153741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLVIy1sMYmb
Name 9,17-Dithia-2,3-diazatricyclo[17.2.2.24,7]pentacosa-2,4,6,19,21,22,24-heptaene, (E)-
CAS Registry Number 114038-80-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2S2
InChI InChI=1S/C21H26N2S2/c1-2-4-14-24-16-18-6-10-20(11-7-18)22-23-21-12-8-19(9-13-21)17-25-15-5-3-1/h6-13H,1-5,14-17H2/b23-22-
InChIKey UGVQLVMXIAUVHL-FCQUAONHSA-N
Molecular Weight 370.573 g/mol
SMILES c12\N=N/c3ccc(CSCCCCCCCSCc(cc2)cc1)cc3
SPLASH splash10-05gl-5937000000-9f129c08a67614555a61
Source of Spectrum F-43-3794-3
Synonyms 2,10-Dithia-18,19-diaza(11,2)paracyclophane-18-ene 2,10-Dithia-18,19-diaza[11.2]paracyclophane-18-ene 9,17-dithia-2,3-diazatricyclo[17.2.2.2(4,7)]pentacosa-1(21),2,4,6,19,22,24-heptaene
Wiley ID 1354403