| SpectraBase Compound ID | Fwsr3gMOBWX |
|---|---|
| InChI | InChI=1S/C18H14ClNO/c1-2-11-20-12-16(15-5-3-4-6-17(15)20)18(21)13-7-9-14(19)10-8-13/h2-10,12H,1,11H2 |
| InChIKey | BFLYBFIPYUFKHQ-UHFFFAOYSA-N |
| Mol Weight | 295.77 g/mol |
| Molecular Formula | C18H14ClNO |
| Exact Mass | 295.076392 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6FllzwIvlAE |
|---|---|
| Name | 3-(p-Chlorobenzoyl)-1-allylindole |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.076391774 u |
| Formula | C18H14ClNO |
| InChI | InChI=1S/C18H14ClNO/c1-2-11-20-12-16(15-5-3-4-6-17(15)20)18(21)13-7-9-14(19)10-8-13/h2-10,12H,1,11H2 |
| InChIKey | BFLYBFIPYUFKHQ-UHFFFAOYSA-N |
| SMILES | C1(=CN(CC=C)C2=C1C=CC=C2)C(C1=CC=C(C=C1)Cl)=O |