| SpectraBase Spectrum ID |
a73kR10KeB |
| Name |
Benzoic acid, 3-chloro-4,6-dihydroxy-2,5-dimethyl-, 3-hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl ester |
| Alternate Name(s) |
3-Hydroxy-4-(methoxycarbonyl)-2,5-dimethylphenyl 3-chloro-4,6-dihydroxy-2,5-dimethylbenzoate
Methyl 4-(5'-chloro-2',4'-dihydroxy-3',6'-dimethylbenzoyloxy)-2-hydroxy-3,6-dimethylbenzoate(methyl 5-chloro-4-O-demethylbarbatate) |
| CAS Registry Number |
81050-83-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H19ClO7 |
| InChI |
InChI=1S/C19H19ClO7/c1-7-6-11(8(2)15(21)12(7)18(24)26-5)27-19(25)13-9(3)14(20)17(23)10(4)16(13)22/h6,21-23H,1-5H3 |
| InChIKey |
JFNWTTZQPJYAII-UHFFFAOYSA-N |
| Molecular Weight |
394.807 g/mol |
| SMILES |
Oc1c(c(OC(c2c(c(c(c(c2C)Cl)O)C)O)=O)cc(c1C(=O)OC)C)C |
| SPLASH |
splash10-0002-0920000000-115afb16894a39c23869 |
| Source of Spectrum |
B-40-1589-4 |
| Wiley ID |
1366528 |
