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ETHYL-ALPHA-FLUORO-ALPHA-[2-(1,5-DIPHENYL-1,3,4-TRIAZOLYL)-THIO]-ACETATE
SpectraBase Compound ID LLBfDRRoUW6
InChI InChI=1S/C18H16FN3O2S/c1-2-24-17(23)15(19)25-18-21-20-16(13-9-5-3-6-10-13)22(18)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3
InChIKey QEJZTOIRZWQOHW-UHFFFAOYSA-N
Mol Weight 357.4 g/mol
Molecular Formula C18H16FN3O2S
Exact Mass 357.094726 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4937dCJXTsE
Name ETHYL-ALPHA-FLUORO-ALPHA-[2-(1,5-DIPHENYL-1,3,4-TRIAZOLYL)-THIO]-ACETATE
Compound Number 6D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16FN3O2S
InChI InChI=1S/C18H16FN3O2S/c1-2-24-17(23)15(19)25-18-21-20-16(13-9-5-3-6-10-13)22(18)14-11-7-4-8-12-14/h3-12,15H,2H2,1H3
InChIKey QEJZTOIRZWQOHW-UHFFFAOYSA-N
Literature Reference Author M.R.SHAABAN,H.ISHII,T.FUCHIGAMI
Literature Reference Citation J.ORG.CHEM.,66,5633(2001)
Literature Reference DOI 10.1021/jo010300e
Solvent Unknown
Source File Reference UWLU27302