| SpectraBase Compound ID | 8PLdrHLtUcj |
|---|---|
| InChI | InChI=1S/C21H28N6O15P2.2Na.3H2O/c22-17-12-18(24-7-23-17)27(8-25-12)20-16(31)14(29)11(41-20)6-39-44(36,37)42-43(34,35)38-5-10-13(28)15(30)19(40-10)26-3-1-2-9(4-26)21(32)33;;;;;/h1,3-4,7-8,10-11,13-16,19-20,28-31H,2,5-6H2,(H,32,33)(H,34,35)(H,36,37)(H2,22,23,24);;;3*1H2/q;2*+1;;;/p-2/t10-,11-,13-,14-,15-,16-,19-,20-;;;;;/m1...../s1 |
| InChIKey | YZHIKEDDLUNDKP-PWPYCWNMSA-L |
| Mol Weight | 764.44 g/mol |
| Molecular Formula | C21H32N6Na2O18P2 |
| Exact Mass | 764.104371 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | 1pSFVcj4orW |
|---|---|
| Name | ADENOSINE 5'-DIPHOSPHATE, 5' TO 5'-ESTER WITH 3-CARBOXY-1,4-DIHYDRO-1-beta-D-RIBOFURANOSYLPYRIDINE, DISODIUM SALT, TRIHYDRATE |
| Source of Sample | P-L Biochemicals Inc., Milwaukee, Wisconsin |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H31N6Na2O18P2 |
| InChI | InChI=1S/C21H28N6O15P2.2Na.3H2O/c22-17-12-18(24-7-23-17)27(8-25-12)20-16(31)14(29)11(41-20)6-39-44(36,37)42-43(34,35)38-5-10-13(28)15(30)19(40-10)26-3-1-2-9(4-26)21(32)33;;;;;/h1,3-4,7-8,10-11,13-16,19-20,28-31H,2,5-6H2,(H,32,33)(H,34,35)(H,36,37)(H2,22,23,24);;;3*1H2/q;2*+1;;;/p-2/t10-,11-,13-,14-,15-,16-,19-,20-;;;;;/m1...../s1 |
| InChIKey | YZHIKEDDLUNDKP-PWPYCWNMSA-L |
| Molecular Weight | 763.433600 |
| Synonyms | ADENOSINE 5*-DIPHOSPHATE, 5* TO 5*- ESTER WITH 3-CARBOXY-1,4-DIHYDRO-1-B-D- RIBOFURANOSYLPYRIDINE, DISODIUM SALT, TRIHYDRATE |
| Technique | KBr WAFER |