| SpectraBase Compound ID | JyIUOdZRg8l |
|---|---|
| InChI | InChI=1S/C10H18N2O2/c1-3-5-6-7-8-12(9-11)10(13)14-4-2/h3-8H2,1-2H3 |
| InChIKey | HIKNNPRXPWSUHE-UHFFFAOYSA-N |
| Mol Weight | 198.27 g/mol |
| Molecular Formula | C10H18N2O2 |
| Exact Mass | 198.136828 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 8uyhSuKJWzk |
|---|---|
| Name | Ethyl N-cyano-N-hexylcarbamate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 198.136827826 u |
| Formula | C10H18N2O2 |
| InChI | InChI=1S/C10H18N2O2/c1-3-5-6-7-8-12(9-11)10(13)14-4-2/h3-8H2,1-2H3 |
| InChIKey | HIKNNPRXPWSUHE-UHFFFAOYSA-N |
| Molecular Weight | 198.266 g/mol |
| SMILES | C(N(C#N)CCCCCC)(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.933221 |