| SpectraBase Spectrum ID |
GBxRqtfJmk0 |
| Name |
Benzoic acid, 3-chloro-2-hydroxy-4-methoxy-6-pentyl-, 4-carboxy-3-hydroxy-5-propylphenyl ester |
| CAS Registry Number |
120091-98-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H27ClO7 |
| InChI |
InChI=1S/C23H27ClO7/c1-4-6-7-9-14-11-17(30-3)20(24)21(26)19(14)23(29)31-15-10-13(8-5-2)18(22(27)28)16(25)12-15/h10-12,25-26H,4-9H2,1-3H3,(H,27,28) |
| InChIKey |
RTJYIKXLLXOSHD-UHFFFAOYSA-N |
| Molecular Weight |
450.915 g/mol |
| SMILES |
Oc1cc(cc(c1C(=O)O)CCC)OC(c1c(c(Cl)c(cc1CCCCC)OC)O)=O |
| SPLASH |
splash10-00di-0920000000-9ae25d4e8f6ad828b9ce |
| Source of Spectrum |
B-41-1795-4 |
| Synonyms |
3-Chloroimbricaric acid
4-(3'-Chloro-2'-hydroxy-4'-methoxy-6'-pentylbenzoyloxy)-2-hydroxy-6-propylbenzoic acid
4-[(3-chloro-2-hydroxy-4-methoxy-6-pentylbenzoyl)oxy]-2-hydroxy-6-propylbenzoic acid |
| Wiley ID |
1387640 |
