| SpectraBase Compound ID | JydDi41Rhcb |
|---|---|
| InChI | InChI=1S/C8H15NO2/c1-9-5-3-7(4-6-9)8(10)11-2/h7H,3-6H2,1-2H3 |
| InChIKey | KYAOKPRJTMFBTQ-UHFFFAOYSA-N |
| Mol Weight | 157.21 g/mol |
| Molecular Formula | C8H15NO2 |
| Exact Mass | 157.110279 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 9CaQ2VZ1szt |
|---|---|
| Name | 1-Methyl-4-piperidinecarboxylic acid, methyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 157.110278725 u |
| Formula | C8H15NO2 |
| InChI | InChI=1S/C8H15NO2/c1-9-5-3-7(4-6-9)8(10)11-2/h7H,3-6H2,1-2H3 |
| InChIKey | KYAOKPRJTMFBTQ-UHFFFAOYSA-N |
| Molecular Weight | 157.213 g/mol |
| SMILES | C1N(CCC(C1)C(=O)OC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.963315 |