| SpectraBase Compound ID | C5e6i5oayaC |
|---|---|
| InChI | InChI=1S/C17H20N2O/c1-5-11(2)19-16-10-13(20-4)6-7-14(16)15-8-9-18-12(3)17(15)19/h6-11H,5H2,1-4H3 |
| InChIKey | JVGAYPZQOUFGSP-UHFFFAOYSA-N |
| Mol Weight | 268.36 g/mol |
| Molecular Formula | C17H20N2O |
| Exact Mass | 268.157563 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | EICfEowTUbx |
|---|---|
| Name | Harmine, N-(2-butyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.157563271 u |
| Formula | C17H20N2O |
| InChI | InChI=1S/C17H20N2O/c1-5-11(2)19-16-10-13(20-4)6-7-14(16)15-8-9-18-12(3)17(15)19/h6-11H,5H2,1-4H3 |
| InChIKey | JVGAYPZQOUFGSP-UHFFFAOYSA-N |
| Molecular Weight | 268.360 g/mol |
| SMILES | C1(=CC=C2C(=C1)N(C(CC)C)C1=C2C=CN=C1C)OC |