| SpectraBase Spectrum ID |
2mN5CaPdXXc |
| Name |
5-Amino-1-beta-D-ribofuranosyl-imidazole-4-carboxamide 4ME |
| Classification |
Adenosine-regulating agent derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
314.159019819 u |
| Formula |
C13H22N4O5 |
| InChI |
InChI=1S/C13H22N4O5/c1-16(2)12-8(11(14)19)15-6-17(12)13-10(21-4)9(18)7(22-13)5-20-3/h6-7,9-10,13,18H,5H2,1-4H3,(H2,14,19)/t7-,9-,10-,13-/m1/s1 |
| InChIKey |
MXDAWVXGNQJSPD-QYVSTXNMSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
314.342 g/mol |
| Nominal Mass |
314 u |
| Quality |
995 |
| Retention Index |
2411 |
| SMILES |
O[C@]1([C@]([C@](N2C(=C(C(=O)N)N=C2)N(C)C)(O[C@@]1(COC)[H])[H])(OC)[H])[H] |
| SPLASH |
splash10-0005-9400000000-3e1a321a432e76c9b554 |
| Sample Comments |
Methyl position uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
AICA-ribonucleoside 4ME
5-(dimethylamino)-1-(4-hydroxy-3-methoxy-5-(methoxymethyl)oxolan-2-yl)-1H-imidazole-4-carboxamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019710 |
