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3-{2-[(dimethylamino)methylene]acetoacetamido}-2-thiophenecarboxylic acid, methyl ester
SpectraBase Compound ID D8ky9YYuoLj
InChI InChI=1S/C13H16N2O4S/c1-8(16)9(7-15(2)3)12(17)14-10-5-6-20-11(10)13(18)19-4/h5-7H,1-4H3,(H,14,17)
InChIKey AENFASROBXUABZ-UHFFFAOYSA-N
Mol Weight 296.34 g/mol
Molecular Formula C13H16N2O4S
Exact Mass 296.083078 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EC42QJfUlcW
Name 3-{2-[(DIMETHYLAMINO)METHYLENE]ACETOACETAMIDO}-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4S
InChI InChI=1S/C13H16N2O4S/c1-8(16)9(7-15(2)3)12(17)14-10-5-6-20-11(10)13(18)19-4/h5-7H,1-4H3,(H,14,17)
InChIKey AENFASROBXUABZ-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 156-158C
Molecular Weight 296.35
Solvent CDCl3; Reference=TMS; Temperature 297K