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(S)-1,1,1-TRIFLUORO-2-(N-(R)-TERT.-BUTANESULFINYL)-AMINO-2-CYANO-OCTANE
SpectraBase Compound ID 3pLpxUbOWlN
InChI InChI=1S/C13H23F3N2OS/c1-5-6-7-8-9-12(10-17,13(14,15)16)18-20(19)11(2,3)4/h18H,5-9H2,1-4H3/t12-,20?/m1/s1
InChIKey HSKOGCJYRDJWSQ-ZRIYNBNISA-N
Mol Weight 312.4 g/mol
Molecular Formula C13H23F3N2OS
Exact Mass 312.148319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A57qY0Ld2Vh
Name (S)-1,1,1-TRIFLUORO-2-(N-(R)-TERT.-BUTANESULFINYL)-AMINO-2-CYANO-OCTANE
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H23F3N2OS
InChI InChI=1S/C13H23F3N2OS/c1-5-6-7-8-9-12(10-17,13(14,15)16)18-20(19)11(2,3)4/h18H,5-9H2,1-4H3/t12-,20?/m1/s1
InChIKey HSKOGCJYRDJWSQ-ZRIYNBNISA-N
Literature Reference Author H.WANG,X.ZHAO,Y.LI,L.LU
Literature Reference Citation ORG.LETTERS,8,1379(2006)
Literature Reference DOI 10.1021/ol0601186
Molecular Weight 312.394 g/mol
Sample ID 40049
Solvent CDCl3