| SpectraBase Spectrum ID |
9PqxNet9eW2 |
| Name |
Benzoic acid, 2-[2,6-bis(acetyloxy)-4-methylbenzoyl]-3,5-dimethoxy-, methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
430.126382279 u |
| Formula |
C22H22O9 |
| InChI |
InChI=1S/C22H22O9/c1-11-7-17(30-12(2)23)20(18(8-11)31-13(3)24)21(25)19-15(22(26)29-6)9-14(27-4)10-16(19)28-5/h7-10H,1-6H3 |
| InChIKey |
BREPBHOEXHXQKL-UHFFFAOYSA-N |
| Molecular Weight |
430.409 g/mol |
| SMILES |
C1=C(C=C(C(=C1C(=O)OC)C(C1=C(C=C(C=C1OC(=O)C)C)OC(=O)C)=O)OC)OC |
![Benzoic acid, 2-[2,6-bis(acetyloxy)-4-methylbenzoyl]-3,5-dimethoxy-, methyl ester](/api/spectrum/9PqxNet9eW2/structure.png?h=300&w=458 "Benzoic acid, 2-[2,6-bis(acetyloxy)-4-methylbenzoyl]-3,5-dimethoxy-, methyl ester")
