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3-Methyl-5-[(ethoxycarbonyl)amino]-1,3,4-thiadiazoline-2-phenylimine
SpectraBase Compound ID 44hvwtQOA1P
InChI InChI=1S/C12H14N4O2S/c1-3-18-12(17)14-10-15-16(2)11(19-10)13-9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,14,15,17)/b13-11+
InChIKey ARARELUFEMBZRX-ACCUITESSA-N
Mol Weight 278.33 g/mol
Molecular Formula C12H14N4O2S
Exact Mass 278.083747 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CLPwaWtvteS
Name 3-Methyl-5-[(ethoxycarbonyl)amino]-1,3,4-thiadiazoline-2-phenylimine
Alternate Name(s) Ethyl (5E)-4-methyl-5-(phenylimino)-4,5-dihydro-1,3,4-thiadiazol-2-ylcarbamate
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Formula C12H14N4O2S
InChI InChI=1S/C12H14N4O2S/c1-3-18-12(17)14-10-15-16(2)11(19-10)13-9-7-5-4-6-8-9/h4-8H,3H2,1-2H3,(H,14,15,17)/b13-11+
InChIKey ARARELUFEMBZRX-ACCUITESSA-N
Molecular Weight 278.330 g/mol
SMILES N(C=1S\C(N(N1)C)=N\c1ccccc1)C(=O)OCC
SPLASH splash10-004l-9450000000-436fd03ebda9c0c89c63
Source of Spectrum Y-32-279-8
Wiley ID 1281542