| SpectraBase Compound ID | XrrND4RfsS |
|---|---|
| InChI | InChI=1S/C17H33NS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18/h2-16H2,1H3 |
| InChIKey | OCDDFQZMFBDQKD-UHFFFAOYSA-N |
| Mol Weight | 283.5 g/mol |
| Molecular Formula | C17H33NS |
| Exact Mass | 283.233371 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BMU3veqVKuD |
|---|---|
| Name | N-Cetyl thiocyanate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.233371241 u |
| Formula | C17H33NS |
| InChI | InChI=1S/C17H33NS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-17-18/h2-16H2,1H3 |
| InChIKey | OCDDFQZMFBDQKD-UHFFFAOYSA-N |
| SMILES | C(CCCCCCCCCCCCCCC)SC#N |