| SpectraBase Compound ID | 4GG2QmfQHJw |
|---|---|
| InChI | InChI=1S/C15H9NO3/c17-13-11-8-4-5-9-12(11)16(15(13)19)14(18)10-6-2-1-3-7-10/h1-9H |
| InChIKey | YKLHWMNKDGZBAX-UHFFFAOYSA-N |
| Mol Weight | 251.24 g/mol |
| Molecular Formula | C15H9NO3 |
| Exact Mass | 251.058243 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | ItTzozxjQw3 |
|---|---|
| Name | 1-Benzoylindole-2,3-dione |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 251.058243151 u |
| Formula | C15H9NO3 |
| InChI | InChI=1S/C15H9NO3/c17-13-11-8-4-5-9-12(11)16(15(13)19)14(18)10-6-2-1-3-7-10/h1-9H |
| InChIKey | YKLHWMNKDGZBAX-UHFFFAOYSA-N |
| Molecular Weight | 251.241 g/mol |
| SMILES | C=1C2=C(C=CC1)C(=O)C(N2C(C1=CC=CC=C1)=O)=O |
| Spectrum/Structure Validation Score (Raman) | 0.965666 |