| SpectraBase Compound ID | Ba3ahLt2Udi |
|---|---|
| InChI | InChI=1S/C14H11NO2/c16-14(17)11-6-3-5-10-8-9-4-1-2-7-12(9)15-13(10)11/h1-7,15H,8H2,(H,16,17) |
| InChIKey | CTNPWDBDMOFPAT-UHFFFAOYSA-N |
| Mol Weight | 225.25 g/mol |
| Molecular Formula | C14H11NO2 |
| Exact Mass | 225.078979 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3nomGClWhNp |
|---|---|
| Name | 4-Acridancarboxylic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 225.078978596 u |
| Formula | C14H11NO2 |
| InChI | InChI=1S/C14H11NO2/c16-14(17)11-6-3-5-10-8-9-4-1-2-7-12(9)15-13(10)11/h1-7,15H,8H2,(H,16,17) |
| InChIKey | CTNPWDBDMOFPAT-UHFFFAOYSA-N |
| Molecular Weight | 225.247 g/mol |
| SMILES | N1C=2C=CC=CC2CC=2C=CC=C(C(O)=O)C12 |
| Spectrum/Structure Validation Score (Raman) | 0.870103 |