| SpectraBase Compound ID | LxuWeZP7ds9 |
|---|---|
| InChI | InChI=1S/C21H44S/c1-8-18(4)11-9-12-19(5)13-10-14-20(6)15-16-21(22-7)17(2)3/h17-21H,8-16H2,1-7H3 |
| InChIKey | WWHVNVWUIGOBET-UHFFFAOYSA-N |
| Mol Weight | 328.6 g/mol |
| Molecular Formula | C21H44S |
| Exact Mass | 328.316373 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7DqcdRKrcZX |
|---|---|
| Name | Hexadecane, 2,6,10,14-tetramethyl-3-(methylthio)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 328.316372591 u |
| Formula | C21H44S |
| InChI | InChI=1S/C21H44S/c1-8-18(4)11-9-12-19(5)13-10-14-20(6)15-16-21(22-7)17(2)3/h17-21H,8-16H2,1-7H3 |
| InChIKey | WWHVNVWUIGOBET-UHFFFAOYSA-N |
| SMILES | C(CCC(CCCC(CCC(C(C)C)SC)C)C)C(C)CC |