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3-[(3-TRIFLUOROMETHYL)-PHENYL]-AMINO-2-METHYLCYCLOPENT-2-EN-1-ONE
SpectraBase Compound ID Haq1MVrii5v
InChI InChI=1S/C13H12F3NO/c1-8-11(5-6-12(8)18)17-10-4-2-3-9(7-10)13(14,15)16/h2-4,7,17H,5-6H2,1H3
InChIKey ZXRUJXJKXHPABG-UHFFFAOYSA-N
Mol Weight 255.24 g/mol
Molecular Formula C13H12F3NO
Exact Mass 255.087098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gcv57hQVPAf
Name 3-[(3-TRIFLUOROMETHYL)-PHENYL]-AMINO-2-METHYLCYCLOPENT-2-EN-1-ONE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H12F3NO
InChI InChI=1S/C13H12F3NO/c1-8-11(5-6-12(8)18)17-10-4-2-3-9(7-10)13(14,15)16/h2-4,7,17H,5-6H2,1H3
InChIKey ZXRUJXJKXHPABG-UHFFFAOYSA-N
Literature Reference Author A.A.ALI,K.N.WINZENBERG
Literature Reference Citation AUSTR.J.CHEM.,58,870(2005)
Literature Reference DOI 10.1071/CH05188
Molecular Weight 255.240 g/mol
Sample ID 29014
Solvent CDCl3