SpectraBase Spectrum ID |
1VZbQsGrS71 |
Name |
1,4:3,6-Dianhydro-D-glucitol 5-mononitrate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
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/t3-,4+,5+,6+/m0/s1 |
InChIKey |
YWXYYJSYQOXTPL-SLPGGIOYSA-N |
Molecular Weight |
191.139 g/mol |
SMILES |
O[C@@]1([C@@]2([C@@]([C@](ON(=O)=O)(CO2)[H])(OC1)[H])[H])[H] |
SPLASH |
splash10-00kf-9100000000-54ccb7d0368e88c5843d |
Source of Spectrum |
Y1-36-794-3 |
Synonyms |
Isosorbide-5-nitrate
[(3S,3aR,6R,6aS)-3-hydroxy-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate
[(3S,3aR,6R,6aS)-3-oxidanyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan-6-yl] nitrate |
Wiley ID |
1527179 |