| SpectraBase Compound ID | BrgnnBaskR0 |
|---|---|
| InChI | InChI=1S/C15H30N2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16/h17H,2-12,14-15H2,1H3 |
| InChIKey | DKRQDOPNZFOLQD-UHFFFAOYSA-N |
| Mol Weight | 238.42 g/mol |
| Molecular Formula | C15H30N2 |
| Exact Mass | 238.240899 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CJsYr71hkAz |
|---|---|
| Name | Propanenitrile, 3-(dodecylamino)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.240898974 u |
| Formula | C15H30N2 |
| InChI | InChI=1S/C15H30N2/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16/h17H,2-12,14-15H2,1H3 |
| InChIKey | DKRQDOPNZFOLQD-UHFFFAOYSA-N |
| Molecular Weight | 238.419 g/mol |
| SMILES | C(CCCCCCCCCCNCCC#N)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.9247 |