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S-Methyl (E)-anilino([(E)-(4-nitrophenyl)(oxo)methyl]imino)methylthiocarbamate
SpectraBase Compound ID Ho6EAf1dGsi
InChI InChI=1S/C16H14N4O4S/c1-25-16(22)19-15(17-12-5-3-2-4-6-12)18-14(21)11-7-9-13(10-8-11)20(23)24/h2-10H,1H3,(H2,17,18,19,21,22)
InChIKey DOHZUWUXOVKKBH-UHFFFAOYSA-N
Mol Weight 358.37 g/mol
Molecular Formula C16H14N4O4S
Exact Mass 358.073576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H2cXI0IzPEN
Name CARBAMOTHIOIC ACID, [[(4-NITROBENZOYL)AMINO](PHENYLAMINO)METHYLENE]-, S-METHYL ESTER
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Formula C16H14N4O4S
InChI InChI=1S/C16H14N4O4S/c1-25-16(22)19-15(17-12-5-3-2-4-6-12)18-14(21)11-7-9-13(10-8-11)20(23)24/h2-10H,1H3,(H2,17,18,19,21,22)
InChIKey DOHZUWUXOVKKBH-UHFFFAOYSA-N
Instrument Name CH5
Molecular Weight 358.0733
SMILES N(C(SC)=O)\C(Nc1ccccc1)=N\C(=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-0udi-7903000000-6bc593c05108f767d913
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany