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1-(2,2,2-TRIFLURO)-1-(2-METHANESULFANYLPHENYL)-ETHYLAMINE;MAJOR-ISOMER
SpectraBase Compound ID IDzrxmiAaZs
InChI InChI=1S/C9H8F3NS/c1-14-7-5-3-2-4-6(7)8(13)9(10,11)12/h2-5,13H,1H3
InChIKey FNTHKZSLHOOKOP-UHFFFAOYSA-N
Mol Weight 219.23 g/mol
Molecular Formula C9H8F3NS
Exact Mass 219.032955 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5Zax1YiKGOt
Name 1-(2,2,2-TRIFLURO)-1-(2-METHANESULFANYLPHENYL)-ETHYLAMINE;MINOR-ISOMER
Compound Number 8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8F3NS
InChI InChI=1S/C9H8F3NS/c1-14-7-5-3-2-4-6(7)8(13)9(10,11)12/h2-5,13H,1H3
InChIKey FNTHKZSLHOOKOP-UHFFFAOYSA-N
Literature Reference Author F.GOSSELIN,P.D.O.SHEA,S.ROY,R.A.REAMER,C.Y.CHEN,R.P.VOLANTE
Literature Reference Citation ORG.LETTERS,7,355(2005)
Literature Reference DOI 10.1021/ol047431x
Molecular Weight 219.224 g/mol
Sample ID 42008
Solvent CDCl3