| SpectraBase Compound ID | KaICaB90s3e |
|---|---|
| InChI | InChI=1S/C15H11NO/c17-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)16-14/h1-10,16H |
| InChIKey | RLGAYEJPGHIHIB-UHFFFAOYSA-N |
| Mol Weight | 221.26 g/mol |
| Molecular Formula | C15H11NO |
| Exact Mass | 221.084064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | IIO8NKAEPZ3 |
|---|---|
| Name | Indole, 2-benzoyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 221.084063977 u |
| Formula | C15H11NO |
| InChI | InChI=1S/C15H11NO/c17-15(11-6-2-1-3-7-11)14-10-12-8-4-5-9-13(12)16-14/h1-10,16H |
| InChIKey | RLGAYEJPGHIHIB-UHFFFAOYSA-N |
| Molecular Weight | 221.259 g/mol |
| SMILES | C1=CC=CC2=C1C=C(N2)C(=O)C1=CC=CC=C1 |