| SpectraBase Spectrum ID |
3cJpmtphRZv |
| Name |
(3S,4R,5S)-5-phenyl-4-formyl-3-(p-methoxyphenyl)-pyrrolidine-2,2-diethylaminocarboxylate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H27NO6 |
| InChI |
InChI=1S/C24H27NO6/c1-4-30-22(27)24(23(28)31-5-2)20(16-11-13-18(29-3)14-12-16)19(15-26)21(25-24)17-9-7-6-8-10-17/h6-15,19-21,25H,4-5H2,1-3H3/t19-,20-,21-/m1/s1 |
| InChIKey |
FKELDNFRZLUNAH-NJDAHSKKSA-N |
| Instrument Name |
Hewlett Packard 5989B?? |
| Ionization Type |
EI |
| Molecular Weight |
425.481 g/mol |
| Reported Formula |
C24H27NO6 |
| SMILES |
N1C([C@@]([C@]([C@]1(c1ccccc1)[H])(C=O)[H])(c1ccc(cc1)OC)[H])(C(OCC)=O)C(=O)OCC |
| SPLASH |
splash10-0uk9-3190000000-500cddc8ca7b414b1f1f |
| Sample Comments |
mixture of endo/exo isomers (>95:<5), >99% ee, >99% ee |
| Source of Spectrum |
ES2322739B1 |
| Wiley ID |
1841904 |
