| SpectraBase Compound ID | 3E719Xk8g9t |
|---|---|
| InChI | InChI=1S/C17H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-17-14-15-18/h2-14,16-17H2,1H3 |
| InChIKey | NSEZEILPAFNORQ-UHFFFAOYSA-N |
| Mol Weight | 267.5 g/mol |
| Molecular Formula | C17H33NO |
| Exact Mass | 267.256215 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 2du1xLjQXxU |
|---|---|
| Name | 3-(Tetradecyloxy)propionitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 267.256214686 u |
| Formula | C17H33NO |
| InChI | InChI=1S/C17H33NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-19-17-14-15-18/h2-14,16-17H2,1H3 |
| InChIKey | NSEZEILPAFNORQ-UHFFFAOYSA-N |
| Molecular Weight | 267.457 g/mol |
| SMILES | CCCCCCCCCCCCCCOCCC#N |
| Spectrum/Structure Validation Score (Raman) | 0.978637 |