| SpectraBase Compound ID | EVNsl1vOHpl |
|---|---|
| InChI | InChI=1S/C25H52S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25(27-3)24-26-2/h25H,4-24H2,1-3H3 |
| InChIKey | FQDOMDIDSWOZGJ-UHFFFAOYSA-N |
| Mol Weight | 416.8 g/mol |
| Molecular Formula | C25H52S2 |
| Exact Mass | 416.351044 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GV3n9AKWoIs |
|---|---|
| Name | 1,2-bis(Methylthio)tricosane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 416.351044022 u |
| Formula | C25H52S2 |
| InChI | InChI=1S/C25H52S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-25(27-3)24-26-2/h25H,4-24H2,1-3H3 |
| InChIKey | FQDOMDIDSWOZGJ-UHFFFAOYSA-N |
| Molecular Weight | 416.811 g/mol |
| SMILES | C(CCCCCCCCCCCCCCCCCC)CCC(CSC)SC |