| SpectraBase Compound ID | EDW2KbAJoeb |
|---|---|
| InChI | InChI=1S/C15H11NO2/c16-11-6-7-12-13(10-4-2-1-3-5-10)9-15(17)18-14(12)8-11/h1-9H,16H2 |
| InChIKey | APOYRJKYDQZQST-UHFFFAOYSA-N |
| Mol Weight | 237.26 g/mol |
| Molecular Formula | C15H11NO2 |
| Exact Mass | 237.078979 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 5hI473B5yJf |
|---|---|
| Name | 7-Amino-4-phenylcoumarin |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 237.078978596 u |
| Formula | C15H11NO2 |
| InChI | InChI=1S/C15H11NO2/c16-11-6-7-12-13(10-4-2-1-3-5-10)9-15(17)18-14(12)8-11/h1-9H,16H2 |
| InChIKey | APOYRJKYDQZQST-UHFFFAOYSA-N |
| Molecular Weight | 237.258 g/mol |
| SMILES | NC=1C=CC=2C(=CC(OC2C1)=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) | 0.993326 |