| SpectraBase Compound ID | B98ZDwEYD6J |
|---|---|
| InChI | InChI=1S/C8H13NO2/c10-5-6-1-3-9-4-2-7(11)8(6)9/h1,7-8,10-11H,2-5H2/t7-,8-/m1/s1 |
| InChIKey | HJSJELVDQOXCHO-HTQZYQBOSA-N |
| Mol Weight | 155.2 g/mol |
| Molecular Formula | C8H13NO2 |
| Exact Mass | 155.094629 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 20zQu0FHJGc |
|---|---|
| Name | Retronecine |
| CAS Registry Number | 480-85-3 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C8H13NO2 |
| InChI | InChI=1S/C8H13NO2/c10-5-6-1-3-9-4-2-7(11)8(6)9/h1,7-8,10-11H,2-5H2/t7-,8-/m1/s1 |
| InChIKey | HJSJELVDQOXCHO-HTQZYQBOSA-N |
| Molecular Weight | 155.197 g/mol |
| SMILES | OCC=1[C@@]2([C@@](CCN2CC1)(O)[H])[H] |
| SPLASH | splash10-0bu3-7900000000-7ed104d94ad8fa201603 |
| Source of Spectrum | F-48-409-4 |
| Synonyms | (+)-Retronecine (1R,8R)-7-(hydroxymethyl)-2,3,5,8-tetrahydro-1H-pyrrolizin-1-ol (1R,8R)-7-methylol-2,3,5,8-tetrahydro-1H-pyrrolizin-1-ol 1H-pyrrolizine-7-methanol, 2,3,5,7a-tetrahydro-1-hydroxy-, (1R-trans)- 1H-Pyrrolizine-7-methanol, 2,3,5,7a-tetrahydro-1-hydroxy-, (1S-cis)- Heliotridine Retronecin Senecifolinene CCRIS 5776 HSDB 3491 HSDB 3567 NSC 124684 |
| Wiley ID | 1152799 |