| SpectraBase Compound ID | 4dTDUmfK3QX |
|---|---|
| InChI | InChI=1S/C17H20N2O/c1-11(2)10-19-16-9-13(20-4)5-6-14(16)15-7-8-18-12(3)17(15)19/h5-9,11H,10H2,1-4H3 |
| InChIKey | KLOZFDXSEQKOGD-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 | 4XPuRMJlZPp |
|---|---|
| Name | Harmine, N-(2-methylpropyl)- |
| 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/c1-11(2)10-19-16-9-13(20-4)5-6-14(16)15-7-8-18-12(3)17(15)19/h5-9,11H,10H2,1-4H3 |
| InChIKey | KLOZFDXSEQKOGD-UHFFFAOYSA-N |
| Molecular Weight | 268.360 g/mol |
| SMILES | C1(=CC=C2C(=C1)N(CC(C)C)C1=C2C=CN=C1C)OC |