| SpectraBase Compound ID | 2U7Dta4oGI3 |
|---|---|
| InChI | InChI=1S/C19H37NS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19-21/h2-18H2,1H3 |
| InChIKey | VJIRSSFEIRFISD-UHFFFAOYSA-N |
| Mol Weight | 311.6 g/mol |
| Molecular Formula | C19H37NS |
| Exact Mass | 311.264671 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Hl5vG7Hku9U |
|---|---|
| Name | Isothiocyanic acid, octadecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 311.264671369 u |
| Formula | C19H37NS |
| InChI | InChI=1S/C19H37NS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-19-21/h2-18H2,1H3 |
| InChIKey | VJIRSSFEIRFISD-UHFFFAOYSA-N |
| Molecular Weight | 311.572 g/mol |
| SMILES | C(CCCCCCCCC)CCCCCCCCN=C=S |