| SpectraBase Compound ID | CA5sobOUrlk |
|---|---|
| InChI | InChI=1S/C17H22N2O/c1-12-5-7-19(8-6-12)11-17(20)15-10-18-16-4-3-13(2)9-14(15)16/h3-4,9-10,12,18H,5-8,11H2,1-2H3 |
| InChIKey | MRABMIYQDIIZCR-UHFFFAOYSA-N |
| Mol Weight | 270.38 g/mol |
| Molecular Formula | C17H22N2O |
| Exact Mass | 270.173213 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7JhBOglMFdN |
|---|---|
| Name | 1-(5-Methyl-1H-indol-3-yl)-2-(4-methyl-1-piperidinyl)ethanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 270.173213335 u |
| Formula | C17H22N2O |
| InChI | InChI=1S/C17H22N2O/c1-12-5-7-19(8-6-12)11-17(20)15-10-18-16-4-3-13(2)9-14(15)16/h3-4,9-10,12,18H,5-8,11H2,1-2H3 |
| InChIKey | MRABMIYQDIIZCR-UHFFFAOYSA-N |
| Molecular Weight | 270.376 g/mol |
| SMILES | N1C=2C(C(=C1)C(CN1CCC(CC1)C)=O)=CC(=CC2)C |