| SpectraBase Spectrum ID |
1BFz5sMsRVS |
| Name |
(4R,5S)-5-(2-Hydroxyphenyl)-4-(2-methoxyphenyl)-1-phenylpyrrolidin-2-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
359.152143537 u |
| Formula |
C23H21NO3 |
| InChI |
InChI=1S/C23H21NO3/c1-27-21-14-8-6-11-17(21)19-15-22(26)24(16-9-3-2-4-10-16)23(19)18-12-5-7-13-20(18)25/h2-14,19,23,25H,15H2,1H3/t19-,23-/m1/s1 |
| InChIKey |
DBGJLPBFKHEHPL-AUSIDOKSSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201703263 |
| Molecular Weight |
359.425 g/mol |
| Optical Rotation |
[a]D20 = +12.3 (c = 1.45, CHCl3) |
| Quality |
150 |
| Reported Formula |
C23H21NO3 |
| SMILES |
OC1=C(C=CC=C1)[C@@]1([C@](CC(N1C1=CC=CC=C1)=O)(C1=C(C=CC=C1)OC)[H])[H] |
| SPLASH |
splash10-052b-1916000000-5f64be1ed4500bc57e2b |
| Sample Comments |
dr = 14:1, 87% ee |
| Source of Spectrum |
QE-23-SM19-3q (DOI: 10.1002/chem.201703263) |
| Wiley ID |
1905941 |
