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

*Links on SpectraBase are not permalinks.

(2-R,3-R)-4-[(4-S)-4-Benzyl-2-oxooxazolidin-3-yl]-3-benzyloxy-2-benzyloxycarbonylamino-4-oxo-2-trifluoromethyl-butyric-acid-ethylester

View entire compound with spectra: 2 NMR

(2-R,3-R)-4-[(4-S)-4-Benzyl-2-oxooxazolidin-3-yl]-3-benzyloxy-2-benzyloxycarbonylamino-4-oxo-2-trifluoromethyl-butyric-acid-ethylester
SpectraBase Compound ID FwatfCbwc5s
InChI InChI=1S/C32H31F3N2O8/c1-2-42-28(39)31(32(33,34)35,36-29(40)44-20-24-16-10-5-11-17-24)26(43-19-23-14-8-4-9-15-23)27(38)37-25(21-45-30(37)41)18-22-12-6-3-7-13-22/h3-17,25-26H,2,18-21H2,1H3,(H,36,40)/t25-,26-,31-/m0/s1
InChIKey NOAZPQQQQFNBRQ-LNFMTQTQSA-N
Mol Weight 628.6 g/mol
Molecular Formula C32H31F3N2O8
Exact Mass 628.20325 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID E6Feyg6s8fw
Name (2-R,3-R)-4-[(4-S)-4-Benzyl-2-oxooxazolidin-3-yl]-3-benzyloxy-2-benzyloxycarbonylamino-4-oxo-2-trifluoromethyl-butyric-acid-ethylester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 628.203250447 u
Formula C32H31F3N2O8
InChI InChI=1S/C32H31F3N2O8/c1-2-42-28(39)31(32(33,34)35,36-29(40)44-20-24-16-10-5-11-17-24)26(43-19-23-14-8-4-9-15-23)27(38)37-25(21-45-30(37)41)18-22-12-6-3-7-13-22/h3-17,25-26H,2,18-21H2,1H3,(H,36,40)/t25-,26-,31-/m0/s1
InChIKey NOAZPQQQQFNBRQ-LNFMTQTQSA-N
Molecular Weight 628.601 g/mol
SMILES C(=O)(OCC)[C@@](C(F)(F)F)(NC(=O)OCC1=CC=CC=C1)[C@@](OCC1=CC=CC=C1)(C(=O)N1C(=O)OC[C@@]1(CC1=CC=CC=C1)[H])[H]