| SpectraBase Spectrum ID |
GA6GsWWEaV5 |
| Name |
(4S,5S)-5-(2-Hydroxyphenyl)-4-methyl-1-phenylpyrrolidin-2-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.125928789 u |
| Formula |
C17H17NO2 |
| InChI |
InChI=1S/C17H17NO2/c1-12-11-16(20)18(13-7-3-2-4-8-13)17(12)14-9-5-6-10-15(14)19/h2-10,12,17,19H,11H2,1H3/t12-,17-/m0/s1 |
| InChIKey |
WGEMRIHMKBHYOC-SJCJKPOMSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201703263 |
| Optical Rotation |
[a]D20 = +48.1 (c = 0.65, CHCl3) |
| Quality |
242 |
| Reported Formula |
C17H17NO2 |
| SMILES |
OC1=C(C=CC=C1)[C@@]1([C@](CC(N1C1=CC=CC=C1)=O)(C)[H])[H] |
| SPLASH |
splash10-014i-3490000000-ed06ade08001baa38a96 |
| Sample Comments |
dr = 9:1, 76% ee |
| Source of Spectrum |
QE-23-SM22-3v (DOI: 10.1002/chem.201703263) |
| Wiley ID |
1905945 |
