![(1S,2S,7S,8aS)-7-[4-(2-Hydroxyethyl)-1H-1,2,3-triazol-1-yl]octahydro-1,2-indolizinediol](/api/spectrum/KCG8gQx0sun/structure.png?h=300&w=458 "(1S,2S,7S,8aS)-7-[4-(2-Hydroxyethyl)-1H-1,2,3-triazol-1-yl]octahydro-1,2-indolizinediol")
| SpectraBase Compound ID | 1UmkrbZqKXZ |
|---|---|
| InChI | InChI=1S/C12H20N4O3/c17-4-2-8-6-16(14-13-8)9-1-3-15-7-11(18)12(19)10(15)5-9/h6,9-12,17-19H,1-5,7H2/t9-,10-,11-,12-/m0/s1 |
| InChIKey | MTABQOFXOWFLRA-BJDJZHNGSA-N |
| Mol Weight | 268.32 g/mol |
| Molecular Formula | C12H20N4O3 |
| Exact Mass | 268.153541 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KCG8gQx0sun |
|---|---|
| Name | (1S,2S,7S,8aS)-7-[4-(2-Hydroxyethyl)-1H-1,2,3-triazol-1-yl]octahydro-1,2-indolizinediol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H20N4O3 |
| InChI | InChI=1S/C12H20N4O3/c17-4-2-8-6-16(14-13-8)9-1-3-15-7-11(18)12(19)10(15)5-9/h6,9-12,17-19H,1-5,7H2/t9-,10-,11-,12-/m0/s1 |
| InChIKey | MTABQOFXOWFLRA-BJDJZHNGSA-N |
| Molecular Weight | 268.317 g/mol |
| SMILES | OCCc1nn[n]([C@@]2(C[C@]3([C@@]([C@](CN3CC2)(O)[H])(O)[H])[H])[H])c1 |
| SPLASH | splash10-00dr-0900000000-b0db02e670015a4b659c |
| Source of Spectrum | F-67-9562-11 |
| Synonyms | (1S,2S,7S,8aS)-7-[4-(2-hydroxyethyl)-1-triazolyl]-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2-diol (1S,2S,7S,8aS)-7-[4-(2-hydroxyethyl)triazol-1-yl]-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2-diol (1S,2S,7S,8aS)-7-[4-(2-hydroxyethyl)-1,2,3-triazol-1-yl]-1,2,3,5,6,7,8,8a-octahydroindolizine-1,2-diol |
| Wiley ID | 1691364 |