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(3S,5S)-3-hydroxy-1-(4-methoxybenzyl)-3,5-diphenylpyrrolidin-2-one
SpectraBase Compound ID LWrHXheO8KW
InChI InChI=1S/C24H23NO3/c1-28-21-14-12-18(13-15-21)17-25-22(19-8-4-2-5-9-19)16-24(27,23(25)26)20-10-6-3-7-11-20/h2-15,22,27H,16-17H2,1H3/t22-,24-/m0/s1
InChIKey SPIWNASLCHEJGZ-UPVQGACJSA-N
Mol Weight 373.45 g/mol
Molecular Formula C24H23NO3
Exact Mass 373.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GhiLncVOLxh
Name (3S,5S)-3-hydroxy-1-(4-methoxybenzyl)-3,5-diphenylpyrrolidin-2-one
Appearance Solid
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Formula C24H23NO3
InChI InChI=1S/C24H23NO3/c1-28-21-14-12-18(13-15-21)17-25-22(19-8-4-2-5-9-19)16-24(27,23(25)26)20-10-6-3-7-11-20/h2-15,22,27H,16-17H2,1H3/t22-,24-/m0/s1
InChIKey SPIWNASLCHEJGZ-UPVQGACJSA-N
Ionization Type EI
Molecular Weight 373.452 g/mol
Optical Rotation [a]D20 = +96 (c = 0.25, CH2Cl2)
SMILES O[C@]1(C(N([C@@](C1)(c1ccccc1)[H])Cc1ccc(cc1)OC)=O)c1ccccc1
SPLASH splash10-05fr-0903000000-ef69bdb54da73803a048
Sample Comments >98% de
Source of Spectrum CN101735134A
Wiley ID 1841654