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2-(anilinomethylene)-4-chloroacetoacetic acid, methyl ester
SpectraBase Compound ID U08Hr8EgU0
InChI InChI=1S/C12H12ClNO3/c1-17-12(16)10(11(15)7-13)8-14-9-5-3-2-4-6-9/h2-6,8,14H,7H2,1H3
InChIKey XKFOHVGCOSHUEU-UHFFFAOYSA-N
Mol Weight 253.68 g/mol
Molecular Formula C12H12ClNO3
Exact Mass 253.050571 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5kG1PjSeTr7
Name 2-(ANILINOMETHYLENE)-4-CHLOROACETOACETIC ACID, METHYL ESTER
Source of Sample O. S. Wolfbeis, University of Graz, Graz, Austria
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClNO3
InChI InChI=1S/C12H12ClNO3/c1-17-12(16)10(11(15)7-13)8-14-9-5-3-2-4-6-9/h2-6,8,14H,7H2,1H3
InChIKey XKFOHVGCOSHUEU-UHFFFAOYSA-N
Melting Point 99C
Molecular Weight 253.69
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms ACETOACETIC ACID, 2-/ANILINOMETHYLENE/-4-CHLORO-, METHYL ESTER