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(ALPHA-S,3S);MAJOR-ISOMER
SpectraBase Compound ID 57YdjfOPSQw
InChI InChI=1S/C13H14F3NO2/c1-8(9-3-5-10(19-2)6-4-9)17-7-11(12(17)18)13(14,15)16/h3-6,8,11H,7H2,1-2H3/t8-,11-/m0/s1
InChIKey YTLAWDDOQNGSDO-KWQFWETISA-N
Mol Weight 273.26 g/mol
Molecular Formula C13H14F3NO2
Exact Mass 273.097663 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 60miCQsb79B
Name (ALPHA-S,3S);MAJOR-ISOMER
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14F3NO2
InChI InChI=1S/C13H14F3NO2/c1-8(9-3-5-10(19-2)6-4-9)17-7-11(12(17)18)13(14,15)16/h3-6,8,11H,7H2,1-2H3/t8-,11-/m0/s1
InChIKey YTLAWDDOQNGSDO-KWQFWETISA-N
Literature Reference Author V.JURCIK,A.M.Z.SLAWIN,D.O'HAGAN
Literature Reference Citation BEIL.J.ORG.CHEM.,7,759(2011)
Literature Reference DOI 10.3762/bjoc.7.86
Molecular Weight 273.255 g/mol
Solvent CDCl3
Source File Reference UWBT9891