| SpectraBase Compound ID | 8GKSMBYVw5Y |
|---|---|
| InChI | InChI=1S/C26H54S2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26(28-4)25(6-2)27-3/h25-26H,5-24H2,1-4H3 |
| InChIKey | WBZYGMNVWKLSBB-UHFFFAOYSA-N |
| Mol Weight | 430.8 g/mol |
| Molecular Formula | C26H54S2 |
| Exact Mass | 430.366694 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HqVJjf2zIHw |
|---|---|
| Name | 3,4-bis(Methylthio)tetracosane |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 430.366694087 u |
| Formula | C26H54S2 |
| InChI | InChI=1S/C26H54S2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-26(28-4)25(6-2)27-3/h25-26H,5-24H2,1-4H3 |
| InChIKey | WBZYGMNVWKLSBB-UHFFFAOYSA-N |
| Molecular Weight | 430.838 g/mol |
| SMILES | C(CCCCCCCCCCCCCCCCC)CCC(C(SC)CC)SC |