| SpectraBase Compound ID | HQU61JkKQvx |
|---|---|
| InChI | InChI=1S/C7H11NO3/c1-11-7(10)5-2-3-6(9)8-4-5/h5H,2-4H2,1H3,(H,8,9) |
| InChIKey | YORUFIOEZHJAEZ-UHFFFAOYSA-N |
| Mol Weight | 157.17 g/mol |
| Molecular Formula | C7H11NO3 |
| Exact Mass | 157.073893 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | FkbR6ElB1sm |
|---|---|
| Name | Piperidin-2-one-5-carboxylic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 157.073893215 u |
| Formula | C7H11NO3 |
| InChI | InChI=1S/C7H11NO3/c1-11-7(10)5-2-3-6(9)8-4-5/h5H,2-4H2,1H3,(H,8,9) |
| InChIKey | YORUFIOEZHJAEZ-UHFFFAOYSA-N |
| Molecular Weight | 157.169 g/mol |
| SMILES | C1(CCC(CN1)C(=O)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.912334 |