| SpectraBase Spectrum ID |
6cjDh53G8o9 |
| Name |
Benzoic acid, 2,4-dihydroxy-6-propyl-, 4-carboxy-3-hydroxy-5-pentylphenyl ester |
| CAS Registry Number |
68671-32-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O7 |
| InChI |
InChI=1S/C22H26O7/c1-3-5-6-8-14-10-16(12-18(25)19(14)21(26)27)29-22(28)20-13(7-4-2)9-15(23)11-17(20)24/h9-12,23-25H,3-8H2,1-2H3,(H,26,27) |
| InChIKey |
GAWIIZNUKGOBMI-UHFFFAOYSA-N |
| Molecular Weight |
402.443 g/mol |
| SMILES |
Oc1cc(OC(c2c(cc(cc2CCC)O)O)=O)cc(c1C(=O)O)CCCCC |
| SPLASH |
splash10-00di-0910000000-6142147a2a75c322aa67 |
| Source of Spectrum |
B-38-1870-3 |
| Synonyms |
4-(2',4'-Dihydroxy-6'-propylbenzoyloxy)-2-hydroxy-6-pentylbenzoic acid
4-[(2,4-dihydroxy-6-propylbenzoyl)oxy]-2-hydroxy-6-pentylbenzoic acid |
| Wiley ID |
1370356 |
