![6-Propylergoline-8-methanol [6-propyldihydrolysergol]](/api/spectrum/F7jzZikBAEp/structure.png?h=300&w=458 "6-Propylergoline-8-methanol [6-propyldihydrolysergol]")
| SpectraBase Compound ID | L4un41EO0Pu |
|---|---|
| InChI | InChI=1S/C18H24N2O/c1-2-6-20-10-12(11-21)7-15-14-4-3-5-16-18(14)13(9-19-16)8-17(15)20/h3-5,9,12,15,17,19,21H,2,6-8,10-11H2,1H3/t12-,15-,17-/m1/s1 |
| InChIKey | IFLVQYOUQKHWMC-SRCQZFHVSA-N |
| Mol Weight | 284.4 g/mol |
| Molecular Formula | C18H24N2O |
| Exact Mass | 284.188863 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | F7jzZikBAEp |
|---|---|
| Name | 6-Propylergoline-8-methanol [6-propyldihydrolysergol] |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 284.188863400 u |
| Formula | C18H24N2O |
| InChI | InChI=1S/C18H24N2O/c1-2-6-20-10-12(11-21)7-15-14-4-3-5-16-18(14)13(9-19-16)8-17(15)20/h3-5,9,12,15,17,19,21H,2,6-8,10-11H2,1H3/t12-,15-,17-/m1/s1 |
| InChIKey | IFLVQYOUQKHWMC-SRCQZFHVSA-N |
| Molecular Weight | 284.403 g/mol |
| SMILES | C=12C3=C(C=CC=C3NC1)[C@@]1([C@@](C2)(N(C[C@](CO)(C1)[H])CCC)[H])[H] |