| SpectraBase Spectrum ID |
7472LgpETg3 |
| Name |
3-Ketopiperidine-1,4-dicarboxylic acid O4-ethyl ester O1-methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
229.095022582 u |
| Formula |
C10H15NO5 |
| InChI |
InChI=1S/C10H15NO5/c1-3-16-9(13)7-4-5-11(6-8(7)12)10(14)15-2/h7H,3-6H2,1-2H3 |
| InChIKey |
PTKLDHADMDDGDN-UHFFFAOYSA-N |
| Molecular Weight |
229.232 g/mol |
| SMILES |
C(N1CC(=O)C(CC1)C(=O)OCC)(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954985 |
