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(phenylmethyl) N-[(2R)-3-[(4S,5R)-4-methyl-2-oxidanylidene-5-phenyl-1,3-oxazolidin-3-yl]-3-oxidanylidene-2-(phenylmethyl)propyl]carbamate
SpectraBase Compound ID DjMrJIIz9RH
InChI InChI=1S/C28H28N2O5/c1-20-25(23-15-9-4-10-16-23)35-28(33)30(20)26(31)24(17-21-11-5-2-6-12-21)18-29-27(32)34-19-22-13-7-3-8-14-22/h2-16,20,24-25H,17-19H2,1H3,(H,29,32)/t20-,24+,25-/m0/s1
InChIKey AUCALDOBUGLUGI-AMDXRBSFSA-N
Mol Weight 472.54 g/mol
Molecular Formula C28H28N2O5
Exact Mass 472.199822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59IrnSOWfIg
Name (Phenylmethyl) N-[(2R)-3-[(4S,5R)-4-methyl-2-oxidanylidene-5-phenyl-1,3-oxazolidin-3-yl]-3-oxidanylidene-2-(phenylmethyl)propyl]carbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.199822005 u
Formula C28H28N2O5
InChI InChI=1S/C28H28N2O5/c1-20-25(23-15-9-4-10-16-23)35-28(33)30(20)26(31)24(17-21-11-5-2-6-12-21)18-29-27(32)34-19-22-13-7-3-8-14-22/h2-16,20,24-25H,17-19H2,1H3,(H,29,32)/t20-,24+,25-/m0/s1
InChIKey AUCALDOBUGLUGI-AMDXRBSFSA-N
Molecular Weight 472.541 g/mol
SMILES C1(N([C@]([C@](O1)(C=1C=CC=CC1)[H])(C)[H])C([C@@](CNC(=O)OCC=1C=CC=CC1)(CC1=CC=CC=C1)[H])=O)=O