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(S)-4-Benzyl-3-[(2R,3R)-2-methyl-4-(dimethylcarbamoyl)-3-phenylbutanoyl]-2,2,5,5-tetramethyloxazolidine
SpectraBase Compound ID AMKBNXzwkvP
InChI InChI=1S/C28H38N2O3/c1-20(23(19-25(31)29(6)7)22-16-12-9-13-17-22)26(32)30-24(18-21-14-10-8-11-15-21)27(2,3)33-28(30,4)5/h8-17,20,23-24H,18-19H2,1-7H3/t20-,23-,24+/m1/s1
InChIKey XUDKCDBUSFGJNN-HUVFLSCGSA-N
Mol Weight 450.6 g/mol
Molecular Formula C28H38N2O3
Exact Mass 450.288243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kra8Urarsto
Name (S)-4-Benzyl-3-[(2R,3R)-2-methyl-4-(dimethylcarbamoyl)-3-phenylbutanoyl]-2,2,5,5-tetramethyloxazolidine
Alternate Name(s) (3R,4R)-5-[(4S)-4-benzyl-2,2,5,5-tetramethyl-1,3-oxazolidin-3-yl]-N,N,4-trimethyl-5-oxo-3-phenylpentanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H38N2O3
InChI InChI=1S/C28H38N2O3/c1-20(23(19-25(31)29(6)7)22-16-12-9-13-17-22)26(32)30-24(18-21-14-10-8-11-15-21)27(2,3)33-28(30,4)5/h8-17,20,23-24H,18-19H2,1-7H3/t20-,23-,24+/m1/s1
InChIKey XUDKCDBUSFGJNN-HUVFLSCGSA-N
Molecular Weight 450.623 g/mol
SMILES C(N1C(OC([C@@]1(Cc1ccccc1)[H])(C)C)(C)C)([C@@]([C@@](CC(N(C)C)=O)(c1ccccc1)[H])(C)[H])=O
SPLASH splash10-001i-5090000000-23ff3aa2ba2d04a877c3
Source of Spectrum F-51-10473-3
Wiley ID 793446