| SpectraBase Spectrum ID |
Hmmup5Auik0 |
| Name |
2-Methylbenzoic acid (9,10-diketo-5-o-toluoyloxy-1-anthryl) ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
476.125988358 u |
| Formula |
C30H20O6 |
| InChI |
InChI=1S/C30H20O6/c1-17-9-3-5-11-19(17)29(33)35-23-15-7-13-21-25(23)27(31)22-14-8-16-24(26(22)28(21)32)36-30(34)20-12-6-4-10-18(20)2/h3-16H,1-2H3 |
| InChIKey |
UAMWVGCIUOHWPD-UHFFFAOYSA-N |
| Molecular Weight |
476.484 g/mol |
| SMILES |
C=12C(C3=CC=CC(=C3C(C2=CC=CC1OC(C1=C(C)C=CC=C1)=O)=O)OC(C1=C(C)C=CC=C1)=O)=O |
