| SpectraBase Spectrum ID |
AtP3A0lHYtx |
| Name |
1-Hydroxy-5-methoxy-2-(2-oxopropyl)anthracene-9,10-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.084123546 u |
| Formula |
C18H14O5 |
| InChI |
InChI=1S/C18H14O5/c1-9(19)8-10-6-7-12-15(16(10)20)18(22)11-4-3-5-13(23-2)14(11)17(12)21/h3-7,20H,8H2,1-2H3 |
| InChIKey |
PNJJBAFYQVHFLD-UHFFFAOYSA-N |
| Molecular Weight |
310.305 g/mol |
| SMILES |
C=12C(C=3C=CC=C(C3C(C2=CC=C(C1O)CC(=O)C)=O)OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.886703 |
