| SpectraBase Spectrum ID |
B4LEhu3yCmW |
| Name |
(2S,3S)-2-Methyl-5-oxo-2-phenylpyrrolidine-3-carboxylic acid |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
219.089543280 u |
| Formula |
C12H13NO3 |
| InChI |
InChI=1S/C12H13NO3/c1-12(8-5-3-2-4-6-8)9(11(15)16)7-10(14)13-12/h2-6,9H,7H2,1H3,(H,13,14)(H,15,16)/t9-,12-/m1/s1 |
| InChIKey |
JQEBQTQWTWWMFS-BXKDBHETSA-N |
| Instrument Name |
Thermo Finnigan Polaris Q |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201900685 |
| Molecular Weight |
219.240 g/mol |
| Quality |
149 |
| Reported Formula |
C12H13NO3 |
| SMILES |
N1C(C[C@](C(=O)O)([C@@]1(C)C1=CC=CC=C1)[H])=O |
| SPLASH |
splash10-0f89-0940000000-33f750c0adfed7be28a6 |
| Sample Comments |
dr = 99:1 |
| Source of Spectrum |
K1-2019-4715-(2S,3S)-1k (DOI: 10.1002/ejoc.201900685) |
| Wiley ID |
1891965 |
