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3-(1,3-benzothiazol-2-ylamino)-3-keto-propionic acid ethyl ester
SpectraBase Compound ID A89FLiXW8Vf
InChI InChI=1S/C12H12N2O3S/c1-2-17-11(16)7-10(15)14-12-13-8-5-3-4-6-9(8)18-12/h3-6H,2,7H2,1H3,(H,13,14,15)
InChIKey NVCMBFZXLYWPCU-UHFFFAOYSA-N
Mol Weight 264.3 g/mol
Molecular Formula C12H12N2O3S
Exact Mass 264.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1JNtpNtlxpG
Name 3-(1,3-benzothiazol-2-ylamino)-3-keto-propionic acid ethyl ester
Alternate Name(s) 3-(1,3-benzothiazol-2-ylamino)-3-oxopropanoic acid ethyl ester Ethyl 3-(1,3-benzothiazol-2-ylamino)-3-oxidanylidene-propanoate Ethyl 3-(1,3-benzothiazol-2-ylamino)-3-oxo-propanoate
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Formula C12H12N2O3S
InChI InChI=1S/C12H12N2O3S/c1-2-17-11(16)7-10(15)14-12-13-8-5-3-4-6-9(8)18-12/h3-6H,2,7H2,1H3,(H,13,14,15)
InChIKey NVCMBFZXLYWPCU-UHFFFAOYSA-N
Molecular Weight 264.299 g/mol
SMILES N(c1nc2ccccc2s1)C(CC(=O)OCC)=O
SPLASH splash10-0gx4-0910000000-8d14487c3b95eeda786c
Source of Spectrum B-48-1861-0
Wiley ID 1267555