SpectraBase Spectrum ID |
1tpELtSu4P3 |
Name |
1-Hydroxy-2-(prop-2-en-1-yloxy)anthracene-9,10-dione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
280.073558862 u |
Formula |
C17H12O4 |
InChI |
InChI=1S/C17H12O4/c1-2-9-21-13-8-7-12-14(17(13)20)16(19)11-6-4-3-5-10(11)15(12)18/h2-8,20H,1,9H2 |
InChIKey |
CFGQJMGCSSOFOB-UHFFFAOYSA-N |
SMILES |
C12=C(C(C=3C(C2=O)=CC=CC3)=O)C(=C(C=C1)OCC=C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.863604 |