![Urea, N,N'-bis[6-(methylsulfinyl)hexyl]-, (.+-.)-](/api/spectrum/I9j8FX9Ip7e/structure.png?h=300&w=458 "Urea, N,N'-bis[6-(methylsulfinyl)hexyl]-, (.+-.)-")
| SpectraBase Compound ID | 3JrxqLXitou |
|---|---|
| InChI | InChI=1S/C15H32N2O3S2/c1-21(19)13-9-5-3-7-11-16-15(18)17-12-8-4-6-10-14-22(2)20/h3-14H2,1-2H3,(H2,16,17,18) |
| InChIKey | RGRPFEZBDDSTNV-UHFFFAOYSA-N |
| Mol Weight | 352.6 g/mol |
| Molecular Formula | C15H32N2O3S2 |
| Exact Mass | 352.185435 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I9j8FX9Ip7e |
|---|---|
| Name | Urea, N,N'-bis[6-(methylsulfinyl)hexyl]-, (.+-.)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.185435243 u |
| Formula | C15H32N2O3S2 |
| InChI | InChI=1S/C15H32N2O3S2/c1-21(19)13-9-5-3-7-11-16-15(18)17-12-8-4-6-10-14-22(2)20/h3-14H2,1-2H3,(H2,16,17,18) |
| InChIKey | RGRPFEZBDDSTNV-UHFFFAOYSA-N |
| Molecular Weight | 352.552 g/mol |
| SMILES | C(NCCCCCCS(C)=O)(=O)NCCCCCCS(C)=O |