| SpectraBase Compound ID | 2yJnxPcaxz6 |
|---|---|
| InChI | InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 |
| InChIKey | BAWFJGJZGIEFAR-NNYOXOHSSA-N |
| Mol Weight | 663.43 g/mol |
| Molecular Formula | C21H27N7O14P2 |
| Exact Mass | 663.109123 g/mol |
Transmission Infrared (IR) Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | BIBvzXur0rb |
|---|---|
| Name | Nicotinamide-adenine dinucleotide |
| Source of Sample | Calbiochem, EMD Chemicals, Inc., an Affiliate of Merck KGaA, Darmstadt, Germany |
| Catalog Number | 481911 |
| Lot Number | 405776 |
| CAS Registry Number | 64417-72-7 |
| Copyright | Copyright © 2012-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H27N7O14P2 |
| InChI | InChI=1S/C21H27N7O14P2/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(32)14(30)11(41-21)6-39-44(36,37)42-43(34,35)38-5-10-13(29)15(31)20(40-10)27-3-1-2-9(4-27)18(23)33/h1-4,7-8,10-11,13-16,20-21,29-32H,5-6H2,(H5-,22,23,24,25,33,34,35,36,37)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1 |
| InChIKey | BAWFJGJZGIEFAR-NNYOXOHSSA-N |
| Instrument Name | Bio-Rad FTS |
| SMILES | Nc1c2nc[n]([C@]3([C@@]([C@@]([C@@](COP(OP(OC[C@]4(O[C@]([C@@]([C@@]4(O)[H])(O)[H])([n+]4cccc(c4)C(N)=O)[H])[H])(=O)[O-])(=O)O)(O3)[H])(O)[H])(O)[H])[H])c2ncn1 |
| Source of Spectrum | Forensic Spectral Research |
| Technique | KBr0 |