| SpectraBase Compound ID | 59DjCNAhS2t |
|---|---|
| InChI | InChI=1S/C13H10O/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2 |
| InChIKey | GJCOSYZMQJWQCA-UHFFFAOYSA-N |
| Mol Weight | 182.22 g/mol |
| Molecular Formula | C13H10O |
| Exact Mass | 182.073165 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EjQRffQkenj |
|---|---|
| Name | Xanthene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 182.073164941 u |
| Formula | C13H10O |
| InChI | InChI=1S/C13H10O/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2 |
| InChIKey | GJCOSYZMQJWQCA-UHFFFAOYSA-N |
| Molecular Weight | 182.222 g/mol |
| SMILES | C=12C=CC=CC1OC=1C=CC=CC1C2 |
| Spectrum/Structure Validation Score (Raman) | 0.959646 |