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1,15-Diaza-3,4;12,13-dibenzo-16,18-(o-methylbenzo)-8-oxa-5,11-dithiacyclooctadecane-2,14-dione
SpectraBase Compound ID JTkRyQ0zj8W
InChI InChI=1S/C25H24N2O3S2/c1-17-20-9-6-10-21(17)27-25(29)19-8-3-5-12-23(19)32-16-14-30-13-15-31-22-11-4-2-7-18(22)24(28)26-20/h2-12H,13-16H2,1H3,(H,26,28)(H,27,29)
InChIKey CZJZOZSDPUZRCK-UHFFFAOYSA-N
Mol Weight 464.6 g/mol
Molecular Formula C25H24N2O3S2
Exact Mass 464.122835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AsRJZLH5wlf
Name 1,15-Diaza-3,4;12,13-dibenzo-16,18-(o-methylbenzo)-8-oxa-5,11-dithiacyclooctadecane-2,14-dione
Comments Less than 3 mono-isotopic peaks
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Formula C25H24N2O3S2
InChI InChI=1S/C25H24N2O3S2/c1-17-20-9-6-10-21(17)27-25(29)19-8-3-5-12-23(19)32-16-14-30-13-15-31-22-11-4-2-7-18(22)24(28)26-20/h2-12H,13-16H2,1H3,(H,26,28)(H,27,29)
InChIKey CZJZOZSDPUZRCK-UHFFFAOYSA-N
Molecular Weight 464.598 g/mol
SMILES N1c2c(c(NC(c3c(cccc3)SCCOCCSc3c(C1=O)cccc3)=O)ccc2)C
SPLASH splash10-0006-9000100000-98a67c965da8a00e6609
Source of Spectrum C5-2004-603-8
Wiley ID 1616650