For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(3R,4R,5S)-2-butyl-3-phenyl-4-(phenylsulfonyl)-5-(trifluoromethyl)-1,2-oxazolidine
SpectraBase Compound ID 5TUeFhgkblR
InChI InChI=1S/C20H22F3NO3S/c1-2-3-14-24-17(15-10-6-4-7-11-15)18(19(27-24)20(21,22)23)28(25,26)16-12-8-5-9-13-16/h4-13,17-19H,2-3,14H2,1H3/t17-,18-,19-/m1/s1
InChIKey VBCMLENWDBRMSK-GUDVDZBRSA-N
Mol Weight 413.46 g/mol
Molecular Formula C20H22F3NO3S
Exact Mass 413.127249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2QbyIoDERPW
Name (3R,4R,5S)-2-butyl-3-phenyl-4-(phenylsulfonyl)-5-(trifluoromethyl)-1,2-oxazolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22F3NO3S
InChI InChI=1S/C20H22F3NO3S/c1-2-3-14-24-17(15-10-6-4-7-11-15)18(19(27-24)20(21,22)23)28(25,26)16-12-8-5-9-13-16/h4-13,17-19H,2-3,14H2,1H3/t17-,18-,19-/m1/s1
InChIKey VBCMLENWDBRMSK-GUDVDZBRSA-N
Molecular Weight 413.455 g/mol
SMILES [C@]1([C@@](ON([C@@]1(c1ccccc1)[H])CCCC)(C(F)(F)F)[H])(S(=O)(=O)c1ccccc1)[H]
SPLASH splash10-0w90-0095600000-f8a4d33e3014614f1b94
Source of Spectrum KC-0-2764-6
Synonyms (3R,4R,5S)-4-(benzenesulfonyl)-2-butyl-3-phenyl-5-(trifluoromethyl)-1,2-oxazolidine (3R,4R,5S)-4-(benzenesulfonyl)-2-butyl-3-phenyl-5-(trifluoromethyl)isoxazolidine (3R,4R,5S)-4-besyl-2-butyl-3-phenyl-5-(trifluoromethyl)isoxazolidine
Wiley ID 784592