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3-acetyl-2-amino-1-phenyl-2-pentene-1,4-dione
SpectraBase Compound ID JJXHUNiCY0e
InChI InChI=1S/C13H13NO3/c1-8(15)11(9(2)16)12(14)13(17)10-6-4-3-5-7-10/h3-7H,14H2,1-2H3
InChIKey WTFIZXMMUIOZIS-UHFFFAOYSA-N
Mol Weight 231.25 g/mol
Molecular Formula C13H13NO3
Exact Mass 231.089543 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7vjbWwYDNsv
Name 3-ACETYL-2-AMINO-1-PHENYL-2-PENTENE-1,4-DIONE
Source of Sample M. Basato, National Research Council and University of Padova, Padova, Italy
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13NO3
InChI InChI=1S/C13H13NO3/c1-8(15)11(9(2)16)12(14)13(17)10-6-4-3-5-7-10/h3-7H,14H2,1-2H3
InChIKey WTFIZXMMUIOZIS-UHFFFAOYSA-N
Melting Point 178C
Molecular Weight 231.25
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2-PENTENE-1,4-DIONE, 3-ACETYL- 2-AMINO-1-PHENYL-,