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(1-S,2-R)-1-(O-PHENYLACETYL)-2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUORO-1-PHENYLPROPAN-1-OL

View entire compound with spectra: 1 NMR

(1-S,2-R)-1-(O-PHENYLACETYL)-2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUORO-1-PHENYLPROPAN-1-OL
SpectraBase Compound ID CJhIzZT5YA8
InChI InChI=1S/C32H28F3NO4S/c1-23-17-19-27(20-18-23)41-31(32(33,34)35,36-30(38)39-22-25-13-7-3-8-14-25)29(26-15-9-4-10-16-26)40-28(37)21-24-11-5-2-6-12-24/h2-20,29H,21-22H2,1H3,(H,36,38)/t29-,31-/m1/s1
InChIKey KOLQLBDAYNWSME-BVRKHOPBSA-N
Mol Weight 579.6 g/mol
Molecular Formula C32H28F3NO4S
Exact Mass 579.169114 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9Q8rDx8k59Y
Name (1-S,2-R)-1-(O-PHENYLACETYL)-2-[(BENZOYLOXYCARBONYL)-AMINO]-2-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUORO-1-PHENYLPROPAN-1-OL
Compound Number (1-S,2-R)-8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H28F3NO4S
InChI InChI=1S/C32H28F3NO4S/c1-23-17-19-27(20-18-23)41-31(32(33,34)35,36-30(38)39-22-25-13-7-3-8-14-25)29(26-15-9-4-10-16-26)40-28(37)21-24-11-5-2-6-12-24/h2-20,29H,21-22H2,1H3,(H,36,38)/t29-,31-/m1/s1
InChIKey KOLQLBDAYNWSME-BVRKHOPBSA-N
Literature Reference Author A.VOLONTERIO,B.VERGANI,M.CRUCIANELLI,M.ZANDA,P.BRAVO
Literature Reference Citation J.ORG.CHEM.,63,7236(1998)
Literature Reference DOI 10.1021/jo980602p
Solvent CDCl3
Source File Reference UWMZ26168