| SpectraBase Compound ID | 69BtrCT50rC |
|---|---|
| InChI | InChI=1S/C11H16N3O11P3S/c15-26(16,17)24-28(20,21)25-27(18,19)22-5-7-1-2-9(23-7)14-4-3-8-10(14)12-6-13-11(8)29/h3-4,6-7,9H,1-2,5H2,(H,18,19)(H,20,21)(H,12,13,29)(H2,15,16,17)/p-4/t7-,9+/m1/s1 |
| InChIKey | OAXHPOKNQPTVNO-APPZFPTMSA-J |
| Mol Weight | 487.21 g/mol |
| Molecular Formula | C11H12N3O11P3S |
| Exact Mass | 486.94054 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HQeRt9ZkVcl |
|---|---|
| Name | OAXHPOKNQPTVNO-APPZFPTMSA-J |
| Compound Number | 16D |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H12N3O11P3S |
| InChI | InChI=1S/C11H16N3O11P3S/c15-26(16,17)24-28(20,21)25-27(18,19)22-5-7-1-2-9(23-7)14-4-3-8-10(14)12-6-13-11(8)29/h3-4,6-7,9H,1-2,5H2,(H,18,19)(H,20,21)(H,12,13,29)(H2,15,16,17)/p-4/t7-,9+/m1/s1 |
| InChIKey | OAXHPOKNQPTVNO-APPZFPTMSA-J |
| Literature Reference Author | F.SEELA,H.P.MUTH,A.ROELING |
| Literature Reference Citation | HELV.CHIM.ACTA,74,554(1991) |
| Solvent | D2O/TRIS-HClBUFFERPH81:1,0.1MNA4 |
| Source File Reference | UWSF1178 |