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(4S)-4-Isopropyl-3-[2'(R)-methyl-4'(R)-nitro-3'(S)-phenylpentanoyl]-5,5-diphenyloxazolidin-2-one

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(4S)-4-Isopropyl-3-[2'(R)-methyl-4'(R)-nitro-3'(S)-phenylpentanoyl]-5,5-diphenyloxazolidin-2-one
SpectraBase Compound ID 6KU6xSm3PUp
InChI InChI=1S/C30H32N2O5/c1-20(2)27-30(24-16-10-6-11-17-24,25-18-12-7-13-19-25)37-29(34)31(27)28(33)21(3)26(22(4)32(35)36)23-14-8-5-9-15-23/h5-22,26-27H,1-4H3/t21-,22-,26-,27+/m1/s1
InChIKey DCKUQORUNFNKBF-VLHNATBGSA-N
Mol Weight 500.6 g/mol
Molecular Formula C30H32N2O5
Exact Mass 500.231122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4IziwvSQKqG
Name (4S)-4-Isopropyl-3-[2'(R)-methyl-4'(R)-nitro-3'(S)-phenylpentanoyl]-5,5-diphenyloxazolidin-2-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 500.231122133 u
Formula C30H32N2O5
InChI InChI=1S/C30H32N2O5/c1-20(2)27-30(24-16-10-6-11-17-24,25-18-12-7-13-19-25)37-29(34)31(27)28(33)21(3)26(22(4)32(35)36)23-14-8-5-9-15-23/h5-22,26-27H,1-4H3/t21-,22-,26-,27+/m1/s1
InChIKey DCKUQORUNFNKBF-VLHNATBGSA-N
Molecular Weight 500.595 g/mol
SMILES C1(N([C@](C(O1)(C=1C=CC=CC1)C=1C=CC=CC1)(C(C)C)[H])C([C@@]([C@]([C@](N(=O)=O)(C)[H])(C1=CC=CC=C1)[H])(C)[H])=O)=O