| SpectraBase Spectrum ID |
C7Iasl1Hlgu |
| Name |
2-Anthracenecarboxylic acid, 1-amino-9,10-dihydro-9,10-dioxo-; 2-anthroic acid, 1-amino-9,10-dihydro-9,10-dioxo- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.053157770 u |
| Formula |
C15H9NO4 |
| InChI |
InChI=1S/C15H9NO4/c16-12-10(15(19)20)6-5-9-11(12)14(18)8-4-2-1-3-7(8)13(9)17/h1-6H,16H2,(H,19,20) |
| InChIKey |
MMKNBFSDCOALQO-UHFFFAOYSA-N |
| SMILES |
OC(C1=CC=C2C(=C1N)C(C=1C(C2=O)=CC=CC1)=O)=O |
| Spectrum/Structure Validation Score (Raman) |
0.920968 |
