| SpectraBase Compound ID | Ly2b3pwd0No |
|---|---|
| InChI | InChI=1S/C17H33N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h2-16H2,1H3 |
| InChIKey | ZXPWFWWSCFIFII-UHFFFAOYSA-N |
| Mol Weight | 251.5 g/mol |
| Molecular Formula | C17H33N |
| Exact Mass | 251.2613 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | FQj1sBg5EnQ |
|---|---|
| Name | Heptadecanenitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.261300067 u |
| Formula | C17H33N |
| InChI | InChI=1S/C17H33N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18/h2-16H2,1H3 |
| InChIKey | ZXPWFWWSCFIFII-UHFFFAOYSA-N |
| Molecular Weight | 251.458 g/mol |
| SMILES | CCCCCCCCCCCCCCCCC#N |
| Spectrum/Structure Validation Score (Raman) | 0.90622 |