(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 Google Search
Mol Weight	500.6 g/mol
Molecular Formula	C30H32N2O5
Exact Mass	500.231122 g/mol

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SpectraBase Spectrum ID	VsW54Ra2Yy
Name	(4S)-4-Isopropyl-3-[2'(R)-methyl-4'(R)-nitro-3'(S)-phenylpentanoyl]-5,5-diphenyloxazolidin-2-one
Comments	Computed using SmartSpectra Model v1.42
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
Spectrum/Structure Validation Score (Vapor Phase IR)	0.941185