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TERT.-BUTYL-(S)-3-[METHOXY-(TRIFLUOAREMETHYL)-PHENYL-ACETIC-ACID]-3-(2-NAPHTHYL)-PROPANOATE
SpectraBase Compound ID FKxFBXnudB5
InChI InChI=1S/C27H27F3O5/c1-25(2,3)35-23(31)17-22(20-15-14-18-10-8-9-11-19(18)16-20)34-24(32)26(33-4,27(28,29)30)21-12-6-5-7-13-21/h5-16,22H,17H2,1-4H3/t22-,26+/m0/s1
InChIKey LIUCXQYJOAYTDB-BKMJKUGQSA-N
Mol Weight 488.5 g/mol
Molecular Formula C27H27F3O5
Exact Mass 488.181058 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5VMe0HQmfKa
Name TERT.-BUTYL-(S)-3-[METHOXY-(TRIFLUOAREMETHYL)-PHENYL-ACETIC-ACID]-3-(2-NAPHTHYL)-PROPANOATE
Compound Number (S)- 2G-(R)-MTPA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H27F3O5
InChI InChI=1S/C27H27F3O5/c1-25(2,3)35-23(31)17-22(20-15-14-18-10-8-9-11-19(18)16-20)34-24(32)26(33-4,27(28,29)30)21-12-6-5-7-13-21/h5-16,22H,17H2,1-4H3/t22-,26+/m0/s1
InChIKey LIUCXQYJOAYTDB-BKMJKUGQSA-N
Literature Reference Author A.E.DIAZ-ALVAREZ,L.MESAS-SANCHEZ,P.DINER
Literature Reference Citation MOLECULES,19,14273(2014)
Literature Reference DOI 10.3390/molecules190914273
Solvent Unknown
Source File Reference UWIR15391