| SpectraBase Compound ID | 1OSufRFonPJ |
|---|---|
| InChI | InChI=1S/C18H38O3S/c1-3-5-7-8-9-10-11-12-13-14-16-18-21-22(19)20-17-15-6-4-2/h3-18H2,1-2H3 |
| InChIKey | WZGBSFFWUFFWKW-UHFFFAOYSA-N |
| Mol Weight | 334.6 g/mol |
| Molecular Formula | C18H38O3S |
| Exact Mass | 334.254166 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E1tptMjZFP4 |
|---|---|
| Name | Sulfurous acid, pentyl tridecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 334.254166255 u |
| Formula | C18H38O3S |
| InChI | InChI=1S/C18H38O3S/c1-3-5-7-8-9-10-11-12-13-14-16-18-21-22(19)20-17-15-6-4-2/h3-18H2,1-2H3 |
| InChIKey | WZGBSFFWUFFWKW-UHFFFAOYSA-N |
| Molecular Weight | 334.559 g/mol |
| SMILES | CCCCCCCCCCCCCOS(OCCCCC)=O |