| SpectraBase Compound ID | 81CCSbIQ2Em |
|---|---|
| InChI | InChI=1S/C15H10O2/c16-15(17)14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H,(H,16,17) |
| InChIKey | LMFJKKGDLAICPF-UHFFFAOYSA-N |
| Mol Weight | 222.24 g/mol |
| Molecular Formula | C15H10O2 |
| Exact Mass | 222.06808 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | CWazFPKRHbb |
|---|---|
| Name | 9-Phenanthrenecarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 222.068079560 u |
| Formula | C15H10O2 |
| InChI | InChI=1S/C15H10O2/c16-15(17)14-9-10-5-1-2-6-11(10)12-7-3-4-8-13(12)14/h1-9H,(H,16,17) |
| InChIKey | LMFJKKGDLAICPF-UHFFFAOYSA-N |
| Molecular Weight | 222.243 g/mol |
| SMILES | OC(C1=CC=2C=CC=CC2C2=CC=CC=C12)=O |
| Spectrum/Structure Validation Score (Raman) | 0.946779 |