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

*Links on SpectraBase are not permalinks.
(phenylmethyl) N-[(2S,3S)-1,1,1-tris(fluoranyl)-3-(4-methylphenyl)sulfinyl-3-phenyl-propan-2-yl]carbamate
SpectraBase Compound ID CmIVdPg03LS
InChI InChI=1S/C24H22F3NO3S/c1-17-12-14-20(15-13-17)32(30)21(19-10-6-3-7-11-19)22(24(25,26)27)28-23(29)31-16-18-8-4-2-5-9-18/h2-15,21-22H,16H2,1H3,(H,28,29)/t21-,22+,32?/m0/s1
InChIKey DNMZJGLDPGUSEV-YWZIIXBHSA-N
Mol Weight 461.5 g/mol
Molecular Formula C24H22F3NO3S
Exact Mass 461.127249 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 35AwyKLDvfK
Name (phenylmethyl) N-[(2S,3S)-1,1,1-tris(fluoranyl)-3-(4-methylphenyl)sulfinyl-3-phenyl-propan-2-yl]carbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H22F3NO3S
InChI InChI=1S/C24H22F3NO3S/c1-17-12-14-20(15-13-17)32(30)21(19-10-6-3-7-11-19)22(24(25,26)27)28-23(29)31-16-18-8-4-2-5-9-18/h2-15,21-22H,16H2,1H3,(H,28,29)/t21-,22+,32?/m0/s1
InChIKey DNMZJGLDPGUSEV-YWZIIXBHSA-N
Molecular Weight 461.499 g/mol
SMILES N([C@]([C@@](S(c1ccc(cc1)C)=O)(c1ccccc1)[H])(C(F)(F)F)[H])C(=O)OCc1ccccc1
SPLASH splash10-0006-9002100000-c7eab205e9c8664d2408
Source of Spectrum F-54-12803-19
Synonyms benzyl N-[(1S)-2,2,2-trifluoro-1-[(S)-phenyl(p-tolylsulfinyl)methyl]ethyl]carbamate benzyl N-[(2S,3S)-1,1,1-trifluoro-3-(4-methylphenyl)sulfinyl-3-phenylpropan-2-yl]carbamate N-[(1S)-2,2,2-trifluoro-1-[(S)-phenyl(p-tolylsulfinyl)methyl]ethyl]carbamic acid benzyl ester N-[(2S,3S)-1,1,1-trifluoro-3-(4-methylphenyl)sulfinyl-3-phenylpropan-2-yl]carbamic acid (phenylmethyl) ester
Wiley ID 809323