| SpectraBase Spectrum ID |
8H8ZglkCfqa |
| Name |
Didanosine-A |
| CAS Registry Number |
95121-06-5 |
| Classification |
Pharmaceutical drug artifact |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
136.038510764 u |
| Formula |
C5H4N4O |
| InChI |
InChI=1S/C5H4N4O/c10-5-3-4(7-1-6-3)8-2-9-5/h1-2H,(H2,6,7,8,9,10) |
| InChIKey |
FDGQSTZJBFJUBT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
136.114 g/mol |
| Nominal Mass |
136 u |
| Quality |
791 |
| Retention Index |
1335 |
| SMILES |
OC1=C2C(NC=N2)=NC=N1 |
| SPLASH |
splash10-000i-6900000000-0605db9eec50a6393738 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6-Hydroxy-imidazo[5,4-d]pyrimidine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007880 |
