| SpectraBase Compound ID | 51DpKiafgvR |
|---|---|
| InChI | InChI=1S/C11H23O3PS2/c1-7-8-17-11(16-6)15(12,13-9(2)3)14-10(4)5/h7,9-11H,1,8H2,2-6H3 |
| InChIKey | CTAAHUVTTUIAIF-UHFFFAOYSA-N |
| Mol Weight | 298.4 g/mol |
| Molecular Formula | C11H23O3PS2 |
| Exact Mass | 298.082624 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5H01pt0fSij |
|---|---|
| Name | Diisopropyl (allylthiomethylthiomethyl)phosphonate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.082623944 u |
| Formula | C11H23O3PS2 |
| InChI | InChI=1S/C11H23O3PS2/c1-7-8-17-11(16-6)15(12,13-9(2)3)14-10(4)5/h7,9-11H,1,8H2,2-6H3 |
| InChIKey | CTAAHUVTTUIAIF-UHFFFAOYSA-N |
| Molecular Weight | 298.396 g/mol |
| SMILES | C(P(OC(C)C)(OC(C)C)=O)(SCC=C)SC |