| SpectraBase Compound ID | 5bQB2VC4ayY |
|---|---|
| InChI | InChI=1S/C10H15N5O10P2.Ba/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20);/q;+2/p-2/t4-,6-,7-,10-;/m1./s1 |
| InChIKey | AHPLQLCUZPVUCC-MCDZGGTQSA-L |
| Mol Weight | 562.514 g/mol |
| Molecular Formula | C10H13BaN5O10P2 |
| Exact Mass | 562.919013 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D5KZDVT2d3v |
|---|---|
| Name | adenosine 5'-(trihydrogen pyrophosphate), barium salt |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C10H13BaN5O10P2 |
| InChI | InChI=1S/C10H15N5O10P2.Ba/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20;/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20);/q;+2/p-2/t4-,6-,7-,10-;/m1./s1 |
| InChIKey | AHPLQLCUZPVUCC-MCDZGGTQSA-L |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 27702M |
| Solvent | D2O/DCl |