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2-(2,2,2-TRIFLUORO-1-METHOXY-1-PHENYL-ETHYLSULFANYL)-PYRIDINE
SpectraBase Compound ID GqrkgnrWKmc
InChI InChI=1S/2C14H12F3NOS/c2*1-19-13(14(15,16)17,11-7-3-2-4-8-11)20-12-9-5-6-10-18-12/h2*2-10H,1H3
InChIKey RPSIIEWCXXZEGR-UHFFFAOYSA-N
Mol Weight 598.62 g/mol
Molecular Formula C28H24F6N2O2S2
Exact Mass 598.118339 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K8QLgpq7cDO
Name 2-(2,2,2-TRIFLUORO-1-METHOXY-1-PHENYL-ETHYLSULFANYL)-PYRIDINE
Compound Number 35
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H24F6N2O2S2
InChI InChI=1S/2C14H12F3NOS/c2*1-19-13(14(15,16)17,11-7-3-2-4-8-11)20-12-9-5-6-10-18-12/h2*2-10H,1H3
InChIKey RPSIIEWCXXZEGR-UHFFFAOYSA-N
Literature Reference Author J.G.CORDARO,R.G.BERGMAN
Literature Reference Citation J.AM.CHEM.SOC.,126,16912(2004)
Literature Reference DOI 10.1021/ja045859l
Molecular Weight 598.621 g/mol
Solvent CD3CN
Source File Reference UWLU35220