| SpectraBase Spectrum ID |
5XHiobnChBQ |
| Name |
Monosorbitate |
| CAS Registry Number |
16051-77-7 |
| Classification |
Treatment of angina pectoris |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
191.042987008 u |
| Formula |
C6H9NO6 |
| InChI |
InChI=1S/C6H9NO6/c8-3-1-11-6-4(13-7(9)10)2-12-5(3)6/h3-6,8H,1-2H2 |
| InChIKey |
YWXYYJSYQOXTPL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
191.139 g/mol |
| Nominal Mass |
191 u |
| Quality |
886 |
| Retention Index |
1531 |
| SMILES |
OC1C2C(C(CO2)O[N+](=O)[O-])OC1 |
| SPLASH |
splash10-066r-9000000000-7872b74aaaae68d19741 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Elantan
Isosorbide nitrate
Monoket
[(3S,3aR,6R,6aS)-3-Hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_014291 |
