For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(ALPHA-S,3S);MAJOR-ISOMER
SpectraBase Compound ID 74GkUiEdnVc
InChI InChI=1S/C12H12F3NO/c1-8(9-5-3-2-4-6-9)16-7-10(11(16)17)12(13,14)15/h2-6,8,10H,7H2,1H3/t8-,10-/m0/s1
InChIKey ITODSUNZWYYHIH-WPRPVWTQSA-N
Mol Weight 243.23 g/mol
Molecular Formula C12H12F3NO
Exact Mass 243.087098 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 5WqVgvtcfAT
Name (ALPHA-S,3S);MAJOR-ISOMER
Compound Number 5A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12F3NO
InChI InChI=1S/C12H12F3NO/c1-8(9-5-3-2-4-6-9)16-7-10(11(16)17)12(13,14)15/h2-6,8,10H,7H2,1H3/t8-,10-/m0/s1
InChIKey ITODSUNZWYYHIH-WPRPVWTQSA-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 243.229 g/mol
Solvent CDCl3
Source File Reference UWBT9889