| SpectraBase Spectrum ID |
ERus96dycdG |
| Name |
3,8-Dihydroxy-9,10-diketo-1-propyl-anthracene-2-carboxylic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
340.094688229 u |
| Formula |
C19H16O6 |
| InChI |
InChI=1S/C19H16O6/c1-3-5-9-14-11(8-13(21)16(9)19(24)25-2)17(22)10-6-4-7-12(20)15(10)18(14)23/h4,6-8,20-21H,3,5H2,1-2H3 |
| InChIKey |
DQBGDVWDYVVEPU-UHFFFAOYSA-N |
| Molecular Weight |
340.331 g/mol |
| SMILES |
C=1(C(=C(C=C2C(C=3C=CC=C(C3C(C12)=O)O)=O)O)C(=O)OC)CCC |
