| SpectraBase Compound ID | 7EIn3sgDjzg |
|---|---|
| InChI | InChI=1S/C20H21NO2/c1-4-14(2)21-13-18(17-10-5-6-11-19(17)21)20(22)15-8-7-9-16(12-15)23-3/h5-14H,4H2,1-3H3 |
| InChIKey | ASCJIACHKANLQN-UHFFFAOYSA-N |
| Mol Weight | 307.39 g/mol |
| Molecular Formula | C20H21NO2 |
| Exact Mass | 307.157229 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | H76lC1reTBj |
|---|---|
| Name | 1-(but-2-yl)-3-(3-Methoxybenzoyl)indole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 307.157228918 u |
| Formula | C20H21NO2 |
| InChI | InChI=1S/C20H21NO2/c1-4-14(2)21-13-18(17-10-5-6-11-19(17)21)20(22)15-8-7-9-16(12-15)23-3/h5-14H,4H2,1-3H3 |
| InChIKey | ASCJIACHKANLQN-UHFFFAOYSA-N |
| Molecular Weight | 307.393 g/mol |
| SMILES | C=1(C=2C(N(C1)C(CC)C)=CC=CC2)C(C1=CC(=CC=C1)OC)=O |