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1-(BENZYLOXY)-4-(TRIFLUOROMETHYL)-5-ACETOXY-7-PHENYL-2-HEPT-6-EN-2-YNE
SpectraBase Compound ID FaUvhWDmNsg
InChI InChI=1S/C23H21F3O3/c1-18(27)29-22(15-14-19-9-4-2-5-10-19)21(23(24,25)26)13-8-16-28-17-20-11-6-3-7-12-20/h2-7,9-12,14-15,21-22H,16-17H2,1H3/b15-14+/t21-,22-/m0/s1
InChIKey UQWKXHSYVRCYTL-TYOAQRMGSA-N
Mol Weight 402.41 g/mol
Molecular Formula C23H21F3O3
Exact Mass 402.144279 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6N8PLRgUk4p
Name 1-(BENZYLOXY)-4-(TRIFLUOROMETHYL)-5-ACETOXY-7-PHENYL-2-HEPT-6-EN-2-YNE
Compound Number 8C-ACETATE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H21F3O3
InChI InChI=1S/C23H21F3O3/c1-18(27)29-22(15-14-19-9-4-2-5-10-19)21(23(24,25)26)13-8-16-28-17-20-11-6-3-7-12-20/h2-7,9-12,14-15,21-22H,16-17H2,1H3/b15-14+/t21-,22-/m0/s1
InChIKey UQWKXHSYVRCYTL-TYOAQRMGSA-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 UWLU60076