| SpectraBase Spectrum ID |
AhmwmmPJXl6 |
| Name |
1-Methyl-3,8-bis(oxidanyl)-9,10-bis(oxidanylidene)anthracene-2-carboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.047738036 u |
| Formula |
C16H10O6 |
| InChI |
InChI=1S/C16H10O6/c1-6-11-8(5-10(18)12(6)16(21)22)14(19)7-3-2-4-9(17)13(7)15(11)20/h2-5,17-18H,1H3,(H,21,22) |
| InChIKey |
MHABMANUFPZXEB-UHFFFAOYSA-N |
| Molecular Weight |
298.250 g/mol |
| SMILES |
C=12C(C=3C(O)=CC=CC3C(C2=CC(=C(C1C)C(=O)O)O)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854261 |
