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(E,Z)-4-(3,4-Dihydro-2H-1,4-benzothiazin-3-ylidene)-3,4-dimethoxycarbonyl-but-2-enoic acid, methyl ester
SpectraBase Compound ID 7HhXd0vywon
InChI InChI=1S/C17H17NO6S/c1-22-14(19)8-10(16(20)23-2)15(17(21)24-3)12-9-25-13-7-5-4-6-11(13)18-12/h4-8,18H,9H2,1-3H3/b10-8-,15-12-
InChIKey RLKFKRAICWCUJX-GDBOMBKFSA-N
Mol Weight 363.38 g/mol
Molecular Formula C17H17NO6S
Exact Mass 363.077658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LExfLN4mX4m
Name (E,Z)-4-(3,4-Dihydro-2H-1,4-benzothiazin-3-ylidene)-3,4-dimethoxycarbonyl-but-2-enoic acid, methyl ester
Comments reassigned
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Formula C17H17NO6S
InChI InChI=1S/C17H17NO6S/c1-22-14(19)8-10(16(20)23-2)15(17(21)24-3)12-9-25-13-7-5-4-6-11(13)18-12/h4-8,18H,9H2,1-3H3/b10-8-,15-12-
InChIKey RLKFKRAICWCUJX-GDBOMBKFSA-N
Instrument Name Varian XL-200
Literature Reference G. Trapani, A. Reho, A. Latrofa, G.Liso, J. Chem. Soc. Perkin I 1027 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3