John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=14r6SCxlNY8 SpectraBase Spectrum ID=EwE8WMliMo0

(accessed ).
1-(TRIFLUOROMETHYL)-3-[(BENZYLOXY)-METHYL]-4-ACETOXY-1-OCTYNE
SpectraBase Compound ID 14r6SCxlNY8
InChI InChI=1S/C19H23F3O3/c1-3-4-10-18(25-15(2)23)17(11-12-19(20,21)22)14-24-13-16-8-6-5-7-9-16/h5-9,17-18H,3-4,10,13-14H2,1-2H3
InChIKey KSSACIAAICEWDY-UHFFFAOYSA-N
Mol Weight 356.39 g/mol
Molecular Formula C19H23F3O3
Exact Mass 356.15993 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EwE8WMliMo0
Name 1-(TRIFLUOROMETHYL)-3-[(BENZYLOXY)-METHYL]-4-ACETOXY-1-OCTYNE
Compound Number 14A-ACETATE
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23F3O3
InChI InChI=1S/C19H23F3O3/c1-3-4-10-18(25-15(2)23)17(11-12-19(20,21)22)14-24-13-16-8-6-5-7-9-16/h5-9,17-18H,3-4,10,13-14H2,1-2H3
InChIKey KSSACIAAICEWDY-UHFFFAOYSA-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 UWLU60086
SpectraBase Batch ID 12Nb394LGhe