| SpectraBase Compound ID | C1UILdReQUq |
|---|---|
| InChI | InChI=1S/C11H17N4O12P3/c12-11-13-9-7(10(16)14-11)3-4-15(9)8-2-1-6(25-8)5-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-4,6,8H,1-2,5H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,12,13,14,16)/p-4/t6-,8+/m1/s1 |
| InChIKey | WPELLLVTPDMGRM-SVRRBLITSA-J |
| Mol Weight | 486.16 g/mol |
| Molecular Formula | C11H13N4O12P3 |
| Exact Mass | 485.974283 g/mol |
31P Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F5XPKB2XS9H |
|---|---|
| Name | WPELLLVTPDMGRM-SVRRBLITSA-J |
| Compound Number | 15A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C11H13N4O12P3 |
| InChI | InChI=1S/C11H17N4O12P3/c12-11-13-9-7(10(16)14-11)3-4-15(9)8-2-1-6(25-8)5-24-29(20,21)27-30(22,23)26-28(17,18)19/h3-4,6,8H,1-2,5H2,(H,20,21)(H,22,23)(H2,17,18,19)(H3,12,13,14,16)/p-4/t6-,8+/m1/s1 |
| InChIKey | WPELLLVTPDMGRM-SVRRBLITSA-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 | UWSF1175 |