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2-BENZYL-3-TRIFLUOROMETHYL-1,2,3,6,7,7A-HEXAHYDRO-[2]-PYRINDIN-6-ONE;MAJOR-ISOMER
SpectraBase Compound ID MjTFsuLn9T
InChI InChI=1S/C16H16F3NO/c17-16(18,19)15-8-12-6-14(21)7-13(12)10-20(15)9-11-4-2-1-3-5-11/h1-6,13,15H,7-10H2/t13-,15+/m0/s1
InChIKey GACCTCGBHLAXPV-DZGCQCFKSA-N
Mol Weight 295.31 g/mol
Molecular Formula C16H16F3NO
Exact Mass 295.118399 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2pCyU9VhDUH
Name 2-BENZYL-3-TRIFLUOROMETHYL-1,2,3,6,7,7A-HEXAHYDRO-[2]-PYRINDIN-6-ONE;MAJOR-ISOMER
Compound Number TRANS-25
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16F3NO
InChI InChI=1S/C16H16F3NO/c17-16(18,19)15-8-12-6-14(21)7-13(12)10-20(15)9-11-4-2-1-3-5-11/h1-6,13,15H,7-10H2/t13-,15+/m0/s1
InChIKey GACCTCGBHLAXPV-DZGCQCFKSA-N
Literature Reference Author G.MAGUEUR,J.LEGROS,F.MEYER,M.OUREVITCH,B.CROUSSE,D.BONNET-DE LPON
Literature Reference Citation EUR.J.ORG.CHEM.,1258(2005)
Solvent CDCl3
Source File Reference UWSI31082