| SpectraBase Compound ID | Gwtaoc3FunL |
|---|---|
| InChI | InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20) |
| InChIKey | ZKHQWZAMYRWXGA-UHFFFAOYSA-N |
| Mol Weight | 507.18 g/mol |
| Molecular Formula | C10H16N5O13P3 |
| Exact Mass | 506.995747 g/mol |
15N Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5RN2rm0MMoQ |
|---|---|
| Name | Adenosine-tri-phosphate |
| CAS Registry Number | 56-65-5 |
| Comments | COND.FOR 1H COUPL. CONST.:0.08M H2O,PH=7 |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C10H16N5O13P3 |
| InChI | InChI=1S/C10H16N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(26-10)1-25-30(21,22)28-31(23,24)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H,23,24)(H2,11,12,13)(H2,18,19,20) |
| InChIKey | ZKHQWZAMYRWXGA-UHFFFAOYSA-N |
| Instrument Name | Bruker WH-180 |
| Literature Reference | V. Markowski, G.R. Sullivan, J.D. Roberts, J. Am. Chem. Soc. 99, 1381 (1977). |
| NMR Standard | CH3NO2 |
| Observed nucleus | 15N |
| Solvent | H2O |