| SpectraBase Spectrum ID |
Irn3nOFLQsX |
| Name |
(3R,4R,5S)-5-(3,5-dimethoxyphenyl)-4-formyl-3-methyl-pyrrolidine-2,2-diethyl dicarboxylate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27NO7 |
| InChI |
InChI=1S/C20H27NO7/c1-6-27-18(23)20(19(24)28-7-2)12(3)16(11-22)17(21-20)13-8-14(25-4)10-15(9-13)26-5/h8-12,16-17,21H,6-7H2,1-5H3/t12-,16-,17-/m1/s1 |
| InChIKey |
PTVVRVXKBLWASX-CSMYWGQOSA-N |
| Instrument Name |
Hewlett Packard 5989B?? |
| Ionization Type |
EI |
| Molecular Weight |
393.436 g/mol |
| Reported Formula |
C20H27NO7 |
| SMILES |
N1C([C@@]([C@]([C@]1(c1cc(cc(c1)OC)OC)[H])(C=O)[H])(C)[H])(C(OCC)=O)C(=O)OCC |
| SPLASH |
splash10-00dl-2349000000-1d0d4a551ff41fab1849 |
| Sample Comments |
94% ee |
| Source of Spectrum |
ES2322739B1 |
| Wiley ID |
1841907 |
