![N-T-Butyl-N'-2-[2-thiophosphatoethyl]aminoethylurea](/api/spectrum/52c9D5n1qij/structure.png?h=300&w=458 "N-T-Butyl-N'-2-[2-thiophosphatoethyl]aminoethylurea")
| SpectraBase Compound ID | KfWOgPTgIK6 |
|---|---|
| InChI | InChI=1S/C9H22N3O4PS/c1-9(2,3)12-8(13)11-5-4-10-6-7-18-17(14,15)16/h10H,4-7H2,1-3H3,(H2,11,12,13)(H2,14,15,16) |
| InChIKey | YLHRZKSICWOUTK-UHFFFAOYSA-N |
| Mol Weight | 299.33 g/mol |
| Molecular Formula | C9H22N3O4PS |
| Exact Mass | 299.106864 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 52c9D5n1qij |
|---|---|
| Name | N-T-Butyl-N'-2-[2-thiophosphatoethyl]aminoethylurea |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.106864368 u |
| Formula | C9H22N3O4PS |
| InChI | InChI=1S/C9H22N3O4PS/c1-9(2,3)12-8(13)11-5-4-10-6-7-18-17(14,15)16/h10H,4-7H2,1-3H3,(H2,11,12,13)(H2,14,15,16) |
| InChIKey | YLHRZKSICWOUTK-UHFFFAOYSA-N |
| Molecular Weight | 299.326 g/mol |
| SMILES | C(NC(=O)NCCNCCSP(=O)(O)O)(C)(C)C |