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S-{2,5-Bis[(methoxycarbonyl)amino]phenyl}ethanethioate
SpectraBase Compound ID IoPowRzE5ZB
InChI InChI=1S/C12H14N2O5S/c1-7(15)20-10-6-8(13-11(16)18-2)4-5-9(10)14-12(17)19-3/h4-6H,1-3H3,(H,13,16)(H,14,17)
InChIKey MNWDEPMEYKJRLP-UHFFFAOYSA-N
Mol Weight 298.31 g/mol
Molecular Formula C12H14N2O5S
Exact Mass 298.062343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CestOdMxR9n
Name S-{2,5-Bis[(methoxycarbonyl)amino]phenyl}ethanethioate
Alternate Name(s) S-(2,5-bis((methoxycarbonyl)amino)phenyl) ethanethioate
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Formula C12H14N2O5S
InChI InChI=1S/C12H14N2O5S/c1-7(15)20-10-6-8(13-11(16)18-2)4-5-9(10)14-12(17)19-3/h4-6H,1-3H3,(H,13,16)(H,14,17)
InChIKey MNWDEPMEYKJRLP-UHFFFAOYSA-N
Molecular Weight 298.313 g/mol
SMILES N(C(=O)OC)c1c(cc(NC(=O)OC)cc1)SC(=O)C
SPLASH splash10-0a4i-5790000000-5ddf8a1b58bdf81b4635
Source of Spectrum HC-48-1693-3
Wiley ID 1739113