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1-PHENYL-3-(TRIFLUOROMETHYL)-4-ACETOXY-1-OCTYNE
SpectraBase Compound ID LEjIGMwjqW5
InChI InChI=1S/C17H19F3O2/c1-3-4-10-16(22-13(2)21)15(17(18,19)20)12-11-14-8-6-5-7-9-14/h5-9,15-16H,3-4,10H2,1-2H3/t15-,16-/m0/s1
InChIKey HDWULTIQZYQPFE-HOTGVXAUSA-N
Mol Weight 312.33 g/mol
Molecular Formula C17H19F3O2
Exact Mass 312.133714 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 259Ug1RJOPo
Name 1-PHENYL-3-(TRIFLUOROMETHYL)-4-ACETOXY-1-OCTYNE
Compound Number 8F-ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H19F3O2
InChI InChI=1S/C17H19F3O2/c1-3-4-10-16(22-13(2)21)15(17(18,19)20)12-11-14-8-6-5-7-9-14/h5-9,15-16H,3-4,10H2,1-2H3/t15-,16-/m0/s1
InChIKey HDWULTIQZYQPFE-HOTGVXAUSA-N
Literature Reference Author T.SAKAMOTO,K.TAKAHASHI,T.YAMAZAKI,T.KITAZUME
Literature Reference Citation J.ORG.CHEM.,64,9467(1999)
Literature Reference DOI 10.1021/jo991086l
Solvent CDCl3
Source File Reference UWLU60079