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1-(S,S-Diphenylsulfilimino)-2,4-dinitrobenzene
SpectraBase Compound ID JBK5d4qqr8m
InChI InChI=1S/C18H13N3O4S/c22-20(23)14-11-12-17(18(13-14)21(24)25)19-26(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13H
InChIKey ZEIGEUNCSDNAHO-UHFFFAOYSA-N
Mol Weight 367.38 g/mol
Molecular Formula C18H13N3O4S
Exact Mass 367.062677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMbNPDOORy0
Name 1-(S,S-Diphenylsulfilimino)-2,4-dinitrobenzene
Alternate Name(s) 1-[(diphenyl-.lambda.4-sulfanylidene)amino]-2,4-dinitrobenzene (2,4-dinitrophenyl)imino-diphenyl-$l^{4}-sulfane
Comments Less than 3 mono-isotopic peaks
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Formula C18H13N3O4S
InChI InChI=1S/C18H13N3O4S/c22-20(23)14-11-12-17(18(13-14)21(24)25)19-26(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-13H
InChIKey ZEIGEUNCSDNAHO-UHFFFAOYSA-N
Molecular Weight 367.379 g/mol
SMILES c1(N(=O)=O)c(N=S(c2ccccc2)c2ccccc2)ccc(N(=O)=O)c1
SPLASH splash10-000i-0900000000-93b5f5262e621560347b
Source of Spectrum KC-0-516-0
Wiley ID 822211