![N-[3-[(benzylamino)-methyl-phosphoryl]oxypropyl]-4-methyl-benzenesulfonamide](/api/spectrum/5tmAXcV4U93/structure.png?h=300&w=458 "N-[3-[(benzylamino)-methyl-phosphoryl]oxypropyl]-4-methyl-benzenesulfonamide")
| SpectraBase Compound ID | Bay3MyBf9TT |
|---|---|
| InChI | InChI=1S/C18H25N2O4PS/c1-16-9-11-18(12-10-16)26(22,23)20-13-6-14-24-25(2,21)19-15-17-7-4-3-5-8-17/h3-5,7-12,20H,6,13-15H2,1-2H3,(H,19,21) |
| InChIKey | KLUSQGHDMGJEAQ-UHFFFAOYSA-N |
| Mol Weight | 396.44 g/mol |
| Molecular Formula | C18H25N2O4PS |
| Exact Mass | 396.127265 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5tmAXcV4U93 |
|---|---|
| Name | N-[3-[(benzylamino)-methyl-phosphoryl]oxypropyl]-4-methyl-benzenesulfonamide |
| Compound Number | 7E-2 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C18H25N2O4PS |
| InChI | InChI=1S/C18H25N2O4PS/c1-16-9-11-18(12-10-16)26(22,23)20-13-6-14-24-25(2,21)19-15-17-7-4-3-5-8-17/h3-5,7-12,20H,6,13-15H2,1-2H3,(H,19,21) |
| InChIKey | KLUSQGHDMGJEAQ-UHFFFAOYSA-N |
| Literature Reference Author | F.DUJOLS,M.MULLIEZ |
| Literature Reference Citation | EUR.J.ORG.CHEM.,1959(2006) |
| Solvent | CDCl3:D2O |
| Source File Reference | UWSI32258 |