| SpectraBase Spectrum ID |
29QreGShJKx |
| Name |
(2S,5S)-Dimethyl-5-(prop-1-en-1-yl)pyrrolidine-1,2-dicarboxylate |
| Appearance |
Colourless oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.115758027 u |
| Formula |
C11H17NO4 |
| InChI |
InChI=1S/C11H17NO4/c1-4-5-8-6-7-9(10(13)15-2)12(8)11(14)16-3/h4-5,8-9H,6-7H2,1-3H3/t8-,9+/m1/s1 |
| InChIKey |
LQVFZYUDGSETCU-BDAKNGLRSA-N |
| Instrument Name |
Finnigan MAT Incos 50 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201406493 |
| Molecular Weight |
227.260 g/mol |
| Optical Rotation |
[a]D20 = 7.7 (c = 0.475, CHCl3) |
| Quality |
308 |
| Reported Formula |
C11H17NO4 |
| SMILES |
[C@]1(N([C@@](CC1)(C=CC)[H])C(=O)OC)(C(=O)OC)[H] |
| SPLASH |
splash10-016u-8910000000-c6837a4f3c70ade6495f |
| Sample Comments |
E/Z = 1:9 |
| Source of Spectrum |
QE-21-SM6-8 (DOI: 10.1002/chem.201406493) |
| Wiley ID |
1906596 |
