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(3R,4R,5S)-2,3-diphenyl-4-(phenylsulfonyl)-5-(trifluoromethyl)-1,2-oxazolidine

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(3R,4R,5S)-2,3-diphenyl-4-(phenylsulfonyl)-5-(trifluoromethyl)-1,2-oxazolidine
SpectraBase Compound ID DMmkEazrPwG
InChI InChI=1S/C22H18F3NO3S/c23-22(24,25)21-20(30(27,28)18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)26(29-21)17-12-6-2-7-13-17/h1-15,19-21H/t19-,20-,21-/m1/s1
InChIKey SLHSSAQAVFVKJQ-NJDAHSKKSA-N
Mol Weight 433.45 g/mol
Molecular Formula C22H18F3NO3S
Exact Mass 433.095949 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6wvCa28ri9d
Name (3R,4R,5S)-2,3-Diphenyl-4-(phenylsulfonyl)-5-(trifluoromethyl)-1,2-oxazolidine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 433.095949104 u
Formula C22H18F3NO3S
InChI InChI=1S/C22H18F3NO3S/c23-22(24,25)21-20(30(27,28)18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)26(29-21)17-12-6-2-7-13-17/h1-15,19-21H/t19-,20-,21-/m1/s1
InChIKey SLHSSAQAVFVKJQ-NJDAHSKKSA-N
Molecular Weight 433.445 g/mol
SMILES [C@]1([C@@](ON([C@@]1(C1=CC=CC=C1)[H])C=1C=CC=CC1)(C(F)(F)F)[H])(S(=O)(=O)C=1C=CC=CC1)[H]