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4'-(6-METHYL-2-BENZOTHIAZOLYL)MALEANILIC ACID
SpectraBase Compound ID HTHguij8LSw
InChI InChI=1S/C18H14N2O3S/c1-11-2-7-14-15(10-11)24-18(20-14)12-3-5-13(6-4-12)19-16(21)8-9-17(22)23/h2-10H,1H3,(H,19,21)(H,22,23)/b9-8-
InChIKey HDYOIHVTWSZHQB-HJWRWDBZSA-N
Mol Weight 338.38 g/mol
Molecular Formula C18H14N2O3S
Exact Mass 338.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DPwfLGIiIYf
Name (Z)-4-keto-4-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]but-2-enoic acid
CAS Registry Number 19963-02-1
Comments Less than 3 mono-isotopic peaks
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Formula C18H14N2O3S
InChI InChI=1S/C18H14N2O3S/c1-11-2-7-14-15(10-11)24-18(20-14)12-3-5-13(6-4-12)19-16(21)8-9-17(22)23/h2-10H,1H3,(H,19,21)(H,22,23)/b9-8-
InChIKey HDYOIHVTWSZHQB-HJWRWDBZSA-N
Molecular Weight 338.381 g/mol
SMILES N(C(\C=C/C(=O)O)=O)c1ccc(-c2nc3ccc(cc3s2)C)cc1
SPLASH splash10-0006-0091000000-330e000c64735b656597
Source of Spectrum AH-114-603-0
Synonyms (Z)-4-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-4-oxo-2-butenoic acid (Z)-4-[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-4-oxo-but-2-enoic acid (Z)-4-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]amino]-4-oxidanylidene-but-2-enoic acid
Wiley ID 1333633