![N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-methylbenzamide](/api/spectrum/GiRfQsPfRZR/structure.png?h=300&w=458 "N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-methylbenzamide")
| SpectraBase Compound ID | 5od0YAqdMGr |
|---|---|
| InChI | InChI=1S/C18H17ClN2O/c1-12-2-4-13(5-3-12)18(22)20-9-8-14-11-21-17-7-6-15(19)10-16(14)17/h2-7,10-11,21H,8-9H2,1H3,(H,20,22) |
| InChIKey | RCKSTRVCFRYDFV-UHFFFAOYSA-N |
| Mol Weight | 312.8 g/mol |
| Molecular Formula | C18H17ClN2O |
| Exact Mass | 312.102941 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | GiRfQsPfRZR |
|---|---|
| Name | N-[2-(5-Chloro-1H-indol-3-yl)ethyl]-4-methylbenzamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 312.102940874 u |
| Formula | C18H17ClN2O |
| InChI | InChI=1S/C18H17ClN2O/c1-12-2-4-13(5-3-12)18(22)20-9-8-14-11-21-17-7-6-15(19)10-16(14)17/h2-7,10-11,21H,8-9H2,1H3,(H,20,22) |
| InChIKey | RCKSTRVCFRYDFV-UHFFFAOYSA-N |
| SMILES | N(C(C1=CC=C(C=C1)C)=O)CCC1=CNC2=C1C=C(C=C2)Cl |