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EPI-(R)-1-PHENYLHEX-2-YL-(R)-ALPHA-METHOXY-ALPHA-(TRIFLUOROMETHYL)-PHENYLACETATE
SpectraBase Compound ID 5gQjxeTBCCu
InChI InChI=1S/C22H25F3O3/c1-3-4-15-19(16-17-11-7-5-8-12-17)28-20(26)21(27-2,22(23,24)25)18-13-9-6-10-14-18/h5-14,19H,3-4,15-16H2,1-2H3/t19?,21-/m0/s1
InChIKey WZCGSYCWCRIOFZ-QWAKEFERSA-N
Mol Weight 394.43 g/mol
Molecular Formula C22H25F3O3
Exact Mass 394.175579 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LqKEpF4RTAb
Name (S)-1-PHENYLHEX-2-YL-(R)-ALPHA-METHOXY-ALPHA-(TRIFLUOROMETHYL)-PHENYLACETATE
Compound Number S4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H25F3O3
InChI InChI=1S/C22H25F3O3/c1-3-4-15-19(16-17-11-7-5-8-12-17)28-20(26)21(27-2,22(23,24)25)18-13-9-6-10-14-18/h5-14,19H,3-4,15-16H2,1-2H3/t19?,21-/m0/s1
InChIKey WZCGSYCWCRIOFZ-QWAKEFERSA-N
Literature Reference Author P.R.BLAKEMORE,S.P.MARSDEN,H.D.VATER
Literature Reference Citation ORG.LETTERS,8,773(2006)
Literature Reference DOI 10.1021/ol053055k
Molecular Weight 394.434 g/mol
Sample ID 58313
Solvent CDCl3