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POAUKRZUTYZMKH-JTHBVZDNSA-N
SpectraBase Compound ID 7p7O0NNBMdk
InChI InChI=1S/C24H22F3NO3S/c1-17-12-14-20(15-13-17)32-23(24(25,26)27,21(29)19-10-6-3-7-11-19)28-22(30)31-16-18-8-4-2-5-9-18/h2-15,21,29H,16H2,1H3,(H,28,30)/t21-,23+/m0/s1
InChIKey POAUKRZUTYZMKH-JTHBVZDNSA-N
Mol Weight 461.5 g/mol
Molecular Formula C24H22F3NO3S
Exact Mass 461.127249 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gb9QPvz0So2
Name POAUKRZUTYZMKH-JTHBVZDNSA-N
Compound Number (1-R,2-R)-2-[(BENZOYLOXYCARBONYL)-AMINO]-[(4-METHYLPHENYL)-SULFENYL]-3,3,3-TRIFLUORO-1-PHENYLPROPAN-1-OL#(1-R,2-R)-5D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H22F3NO3S
InChI InChI=1S/C24H22F3NO3S/c1-17-12-14-20(15-13-17)32-23(24(25,26)27,21(29)19-10-6-3-7-11-19)28-22(30)31-16-18-8-4-2-5-9-18/h2-15,21,29H,16H2,1H3,(H,28,30)/t21-,23+/m0/s1
InChIKey POAUKRZUTYZMKH-JTHBVZDNSA-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 UWMZ26162