| SpectraBase Compound ID | BFKdk1YB0OR |
|---|---|
| InChI | InChI=1S/C16H13NO/c1-11-13-9-5-6-10-14(13)17-15(11)16(18)12-7-3-2-4-8-12/h2-10,17H,1H3 |
| InChIKey | GYURQDCGGONBOT-UHFFFAOYSA-N |
| Mol Weight | 235.29 g/mol |
| Molecular Formula | C16H13NO |
| Exact Mass | 235.099714 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JAFzgOZWLOt |
|---|---|
| Name | 1H-Indole, 2-benzoyl-3-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.099714042 u |
| Formula | C16H13NO |
| InChI | InChI=1S/C16H13NO/c1-11-13-9-5-6-10-14(13)17-15(11)16(18)12-7-3-2-4-8-12/h2-10,17H,1H3 |
| InChIKey | GYURQDCGGONBOT-UHFFFAOYSA-N |
| Molecular Weight | 235.286 g/mol |
| SMILES | C(=O)(C1=C(C=2C(=CC=CC2)N1)C)C1=CC=CC=C1 |