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O-(o-nitrophenyl)-S-(p-nitrophenyl)-dithiocarbonate
SpectraBase Compound ID FD8FwbIKk9e
InChI InChI=1S/C13H8N2O5S2/c16-14(17)9-5-7-10(8-6-9)22-13(21)20-12-4-2-1-3-11(12)15(18)19/h1-8H
InChIKey RIEWKKROOCKTIA-UHFFFAOYSA-N
Mol Weight 336.34 g/mol
Molecular Formula C13H8N2O5S2
Exact Mass 335.987464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6hz1QM93JOu
Name O-(o-nitrophenyl)-S-(p-nitrophenyl)-dithiocarbonate
Alternate Name(s) O-(2-nitrophenyl) S-(4-nitrophenyl) dithiocarbonate
Comments Less than 3 mono-isotopic peaks
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Formula C13H8N2O5S2
InChI InChI=1S/C13H8N2O5S2/c16-14(17)9-5-7-10(8-6-9)22-13(21)20-12-4-2-1-3-11(12)15(18)19/h1-8H
InChIKey RIEWKKROOCKTIA-UHFFFAOYSA-N
Molecular Weight 336.336 g/mol
SMILES c1(N(=O)=O)c(OC(Sc2ccc(N(=O)=O)cc2)=S)cccc1
SPLASH splash10-0a4i-0109000000-03f21cb49c304038250b
Source of Spectrum O-28-459-0
Wiley ID 1332026