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N4-Benzoyl-N1-(5-methylisoxazol-3-formyl)thiosemicarbazide
SpectraBase Compound ID Ik4V89U0JQz
InChI InChI=1S/C13H12N4O3S/c1-8-7-10(17-20-8)12(19)15-16-13(21)14-11(18)9-5-3-2-4-6-9/h2-7H,1H3,(H,15,19)(H2,14,16,18,21)
InChIKey ABPROMYWYIEZJP-UHFFFAOYSA-N
Mol Weight 304.32 g/mol
Molecular Formula C13H12N4O3S
Exact Mass 304.063011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D4CPOfUSxD4
Name N4-Benzoyl-N1-(5-methylisoxazol-3-formyl)thiosemicarbazide
Alternate Name(s) N-[[[(5-methyl-3-isoxazolyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide N-(2-(5-methylisoxazole-3-carbonyl)hydrazinecarbonothioyl)benzamide N-[[(5-methyl-1,2-oxazole-3-carbonyl)amino]carbamothioyl]benzamide N-[[(5-methylisoxazole-3-carbonyl)amino]carbamothioyl]benzamide N-[[(5-methyl-1,2-oxazol-3-yl)carbonylamino]carbamothioyl]benzamide
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Formula C13H12N4O3S
InChI InChI=1S/C13H12N4O3S/c1-8-7-10(17-20-8)12(19)15-16-13(21)14-11(18)9-5-3-2-4-6-9/h2-7H,1H3,(H,15,19)(H2,14,16,18,21)
InChIKey ABPROMYWYIEZJP-UHFFFAOYSA-N
Molecular Weight 304.324 g/mol
SMILES N(C(=S)NC(c1ccccc1)=O)NC(=O)c1cc(on1)C
SPLASH splash10-0a6r-5900000000-a527224fb84471f8201d
Source of Spectrum Y1-38B-1067-2a
Wiley ID 1743938