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syn-6,18-Diaza-11,23-dithia[2.2](1,4)dibenzocyclooctanophane-5,12,17,24-tetraone
SpectraBase Compound ID AdhZpvtVPRD
InChI InChI=1S/C32H22N2O4S2/c35-29-25-17-9-10-18-12-14-20(28-26(18)30(36)34-22-6-2-4-8-24(22)40-32(28)38)16-15-19(13-11-17)27(25)31(37)39-23-7-3-1-5-21(23)33-29/h1-8,11-14H,9-10,15-16H2,(H,33,35)(H,34,36)
InChIKey SMXZWDWLGFMBTM-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C32H22N2O4S2
Exact Mass 562.1021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9uDr3ssvR3V
Name syn-6,18-Diaza-11,23-dithia[2.2](1,4)dibenzocyclooctanophane-5,12,17,24-tetraone
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H22N2O4S2
InChI InChI=1S/C32H22N2O4S2/c35-29-25-17-9-10-18-12-14-20(28-26(18)30(36)34-22-6-2-4-8-24(22)40-32(28)38)16-15-19(13-11-17)27(25)31(37)39-23-7-3-1-5-21(23)33-29/h1-8,11-14H,9-10,15-16H2,(H,33,35)(H,34,36)
InChIKey SMXZWDWLGFMBTM-UHFFFAOYSA-N
Molecular Weight 562.658 g/mol
SMILES N1c2c(SC(c3c(c4CCc5c6C(Nc7ccccc7SC(c6c(CCc3cc4)cc5)=O)=O)C1=O)=O)cccc2
SPLASH splash10-03e9-0241190000-e159e732f2510d75ee3e
Source of Spectrum KC-1-761-17
Wiley ID 1577667