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(3'S,4S,5R)-1-[3'-(4"'-bromobiphen-4"-yl)-4'-phenylbutanoyl]-1,5-dimethyl-4-phenyl-2-imadazolidinone
SpectraBase Compound ID 6nE3dWUL961
InChI InChI=1S/C33H31BrN2O2/c1-23-32(28-11-7-4-8-12-28)36(33(38)35(23)2)31(37)22-29(21-24-9-5-3-6-10-24)27-15-13-25(14-16-27)26-17-19-30(34)20-18-26/h3-20,23,29,32H,21-22H2,1-2H3/t23-,29+,32-/m1/s1
InChIKey IFALAQYUHWEUAA-IEHNKUDYSA-N
Mol Weight 567.5 g/mol
Molecular Formula C33H31BrN2O2
Exact Mass 566.156891 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3YA6g0lGSib
Name (3'S,4S,5R)-1-[3'-(4"'-bromobiphen-4"-yl)-4'-phenylbutanoyl]-1,5-dimethyl-4-phenyl-2-imadazolidinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H31BrN2O2
InChI InChI=1S/C33H31BrN2O2/c1-23-32(28-11-7-4-8-12-28)36(33(38)35(23)2)31(37)22-29(21-24-9-5-3-6-10-24)27-15-13-25(14-16-27)26-17-19-30(34)20-18-26/h3-20,23,29,32H,21-22H2,1-2H3/t23-,29+,32-/m1/s1
InChIKey IFALAQYUHWEUAA-IEHNKUDYSA-N
Molecular Weight 567.527 g/mol
SMILES C1(N([C@]([C@](N1C)(C)[H])(c1ccccc1)[H])C(C[C@@](c1ccc(cc1)-c1ccc(Br)cc1)(Cc1ccccc1)[H])=O)=O
SPLASH splash10-01ot-0900000000-069d462d070689fc4f0b
Source of Spectrum F-53-6053-16
Synonyms (3'S,4R,5S)-1-[3'-(4'''-bromobiphen-4''-yl)-4'-phenylbutanoyl]-1,5-dimethyl-4-phenyl-2-imadazolidinone (4R,5S)-1-[(3S)-3-[4-(4-bromophenyl)phenyl]-1-oxo-4-phenylbutyl]-3,4-dimethyl-5-phenyl-2-imidazolidinone (4R,5S)-1-[(3S)-3-[4-(4-bromophenyl)phenyl]-4-phenylbutanoyl]-3,4-dimethyl-5-phenylimidazolidin-2-one (4R,5S)-1-[(3S)-3-[4-(4-bromophenyl)phenyl]-4-phenyl-butanoyl]-3,4-dimethyl-5-phenyl-imidazolidin-2-one
Wiley ID 801986