| SpectraBase Compound ID | AL9p26L75uY |
|---|---|
| InChI | InChI=1S/C22H16O/c1-15-10-12-16(13-11-15)14-21-17-6-2-4-8-19(17)22(23)20-9-5-3-7-18(20)21/h2-14H,1H3 |
| InChIKey | KCTYMDUWWAPGIO-UHFFFAOYSA-N |
| Mol Weight | 296.37 g/mol |
| Molecular Formula | C22H16O |
| Exact Mass | 296.120115 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 3JQDJjMXiX7 |
|---|---|
| Name | 10-(p-Methylbenzylidene)anthrone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 296.120115134 u |
| Formula | C22H16O |
| InChI | InChI=1S/C22H16O/c1-15-10-12-16(13-11-15)14-21-17-6-2-4-8-19(17)22(23)20-9-5-3-7-18(20)21/h2-14H,1H3 |
| InChIKey | KCTYMDUWWAPGIO-UHFFFAOYSA-N |
| SMILES | C=1C(=CC=C(C1)C)C=C1C=2C=CC=CC2C(C=2C=CC=CC12)=O |
| Spectrum/Structure Validation Score (Raman) | 0.715553 |