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Ethyl hydrogen [(benzothiazol-2-yl)aminomethylene]malonate
SpectraBase Compound ID Dh5WRlPFrDM
InChI InChI=1S/C13H12N2O4S/c1-2-19-12(18)8(11(16)17)7-14-13-15-9-5-3-4-6-10(9)20-13/h3-7H,2H2,1H3,(H,14,15)(H,16,17)/b8-7-
InChIKey YCMWOGAKSQTZFN-FPLPWBNLSA-N
Mol Weight 292.31 g/mol
Molecular Formula C13H12N2O4S
Exact Mass 292.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID t3AOW6B8K
Name Ethyl hydrogen [(benzothiazol-2-yl)aminomethylene]malonate
Alternate Name(s) (2Z)-3-(1,3-benzothiazol-2-ylamino)-2-(ethoxycarbonyl)-2-propenoic acid
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Formula C13H12N2O4S
InChI InChI=1S/C13H12N2O4S/c1-2-19-12(18)8(11(16)17)7-14-13-15-9-5-3-4-6-10(9)20-13/h3-7H,2H2,1H3,(H,14,15)(H,16,17)/b8-7-
InChIKey YCMWOGAKSQTZFN-FPLPWBNLSA-N
Molecular Weight 292.309 g/mol
SMILES N(c1nc2ccccc2s1)\C=C\(C(=O)O)C(=O)OCC
SPLASH splash10-0uk9-0890000000-eb53c70cabb8a2204f58
Source of Spectrum B-47-1263-0
Wiley ID 1295043