| SpectraBase Spectrum ID |
1Mzm8D7Z4O7 |
| Name |
(2S)-1-Acetyl-2-pyrrolidinecarboxylic acid (phenylmethyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
247.120843408 u |
| Formula |
C14H17NO3 |
| InChI |
InChI=1S/C14H17NO3/c1-11(16)15-9-5-8-13(15)14(17)18-10-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-10H2,1H3/t13-/m0/s1 |
| InChIKey |
UETQDGQFFSJMIL-ZDUSSCGKSA-N |
| Molecular Weight |
247.294 g/mol |
| SMILES |
[C@]1(N(CCC1)C(=O)C)(C(OCC=1C=CC=CC1)=O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842981 |
