| SpectraBase Compound ID | 3q4kZCj7p0E |
|---|---|
| InChI | InChI=1S/C18H22N2O/c1-4-10-20-17-12-14(21-11-5-2)6-7-15(17)16-8-9-19-13(3)18(16)20/h6-9,12H,4-5,10-11H2,1-3H3 |
| InChIKey | BFRVKOJUMINDJC-UHFFFAOYSA-N |
| Mol Weight | 282.39 g/mol |
| Molecular Formula | C18H22N2O |
| Exact Mass | 282.173213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4ab95K5Bg0w |
|---|---|
| Name | Harmol, bis(N-propyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 282.173213335 u |
| Formula | C18H22N2O |
| InChI | InChI=1S/C18H22N2O/c1-4-10-20-17-12-14(21-11-5-2)6-7-15(17)16-8-9-19-13(3)18(16)20/h6-9,12H,4-5,10-11H2,1-3H3 |
| InChIKey | BFRVKOJUMINDJC-UHFFFAOYSA-N |
| SMILES | C1=2C3=C(C=C(C=C3)OCCC)N(C1=C(C)N=CC2)CCC |