![di-Isopropyl-N-[2-chloroethyl]thionophosphoramide](/api/spectrum/E8srD1QGpIO/structure.png?h=300&w=458 "di-Isopropyl-N-[2-chloroethyl]thionophosphoramide")
| SpectraBase Compound ID | Fgg7dRjcVfY |
|---|---|
| InChI | InChI=1S/C8H19ClNO2PS/c1-7(2)11-13(14,10-6-5-9)12-8(3)4/h7-8H,5-6H2,1-4H3,(H,10,14) |
| InChIKey | UJEDHIAICAQFTQ-UHFFFAOYSA-N |
| Mol Weight | 259.73 g/mol |
| Molecular Formula | C8H19ClNO2PS |
| Exact Mass | 259.056265 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | E8srD1QGpIO |
|---|---|
| Name | di-Isopropyl-N-[2-chloroethyl]thionophosphoramide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.056264726 u |
| Formula | C8H19ClNO2PS |
| InChI | InChI=1S/C8H19ClNO2PS/c1-7(2)11-13(14,10-6-5-9)12-8(3)4/h7-8H,5-6H2,1-4H3,(H,10,14) |
| InChIKey | UJEDHIAICAQFTQ-UHFFFAOYSA-N |
| Molecular Weight | 259.732 g/mol |
| SMILES | C(OP(OC(C)C)(=S)NCCCl)(C)C |