| SpectraBase Spectrum ID |
2iZBaDDXou |
| Name |
(2S,3S,4R,5S)-Methyl 4-nitro-1-(3-oxobutyl)-3,5-diphenylpyrrolidine-2-carboxylate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H24N2O5 |
| InChI |
InChI=1S/C22H24N2O5/c1-15(25)13-14-23-19(17-11-7-4-8-12-17)20(24(27)28)18(21(23)22(26)29-2)16-9-5-3-6-10-16/h3-12,18-21H,13-14H2,1-2H3/t18-,19+,20-,21+/m1/s1 |
| InChIKey |
DJPYCJJAHOEAOI-MHTWAQMVSA-N |
| Instrument Name |
Shimadzu QP-5000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/cctc.201902382 |
| Molecular Weight |
396.443 g/mol |
| Optical Rotation |
[a]D17 = 72.0 (c = 1, CHCl3) |
| Reported Formula |
C22H24N2O5 |
| SMILES |
[C@]1(N([C@]([C@@]([C@]1(c1ccccc1)[H])([N+](=O)[O-])[H])(c1ccccc1)[H])CCC(C)=O)(C(OC)=O)[H] |
| SPLASH |
splash10-000x-0192000000-26cfe12cc5416f2db446 |
| Source of Spectrum |
CCC-12-2019-11 |
| Wiley ID |
1839870 |
