| SpectraBase Compound ID | A11gQtjPFO9 |
|---|---|
| InChI | InChI=1S/C9H14N2/c1-3-8-5-4-6-11(2)9(8)7-10/h3-6H2,1-2H3 |
| InChIKey | ZTDLQMQHGXYRPG-UHFFFAOYSA-N |
| Mol Weight | 150.22 g/mol |
| Molecular Formula | C9H14N2 |
| Exact Mass | 150.115698 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | HoB8eh7tYHS |
|---|---|
| Name | 1-Methyl-2-cyano-3-ethyl-2-piperideine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.115698459 u |
| Formula | C9H14N2 |
| InChI | InChI=1S/C9H14N2/c1-3-8-5-4-6-11(2)9(8)7-10/h3-6H2,1-2H3 |
| InChIKey | ZTDLQMQHGXYRPG-UHFFFAOYSA-N |
| Molecular Weight | 150.225 g/mol |
| SMILES | C=1(N(CCCC1CC)C)C#N |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939701 |