| SpectraBase Compound ID | 4KVLSz8LSfL |
|---|---|
| InChI | InChI=1S/C20H21N2O6PS2.C3H9N/c23-29(24,18-10-4-1-5-11-18)22(31(27,28)20-14-8-3-9-15-20)17-16-21-30(25,26)19-12-6-2-7-13-19;1-3(2)4/h1-15,21H,16-17H2,(H,23,24);3H,4H2,1-2H3 |
| InChIKey | VXCITZRLFGJPMC-UHFFFAOYSA-N |
| Mol Weight | 539.6 g/mol |
| Molecular Formula | C23H30N3O6PS2 |
| Exact Mass | 539.131365 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FWz6W1WqwlX |
|---|---|
| Name | PHENYL-PHOSPHONIC-ACID-BIS-N-PHENYLSULFONYLETHYLENEDIAMINE-ISOPROPYLAMMONIUM-SALT |
| Compound Number | 9 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C23H30N3O6PS2 |
| InChI | InChI=1S/C20H21N2O6PS2.C3H9N/c23-29(24,18-10-4-1-5-11-18)22(31(27,28)20-14-8-3-9-15-20)17-16-21-30(25,26)19-12-6-2-7-13-19;1-3(2)4/h1-15,21H,16-17H2,(H,23,24);3H,4H2,1-2H3 |
| InChIKey | VXCITZRLFGJPMC-UHFFFAOYSA-N |
| Literature Reference Author | F.J.DUJOLS,M.E.MULLIEZ |
| Literature Reference Citation | J.HETCYCL.CHEM.,38,475(2001) |
| Literature Reference DOI | 10.1002/jhet.5570380227 |
| Molecular Weight | 539.601 g/mol |
| Solvent | DMSO-D6 |
| Source File Reference | UWSI21028 |