| SpectraBase Spectrum ID |
1JKOQJnbcXh |
| Name |
Benzoic acid, 3-(2-carboxy-4-chloro-6-formyl-5-hydroxy-3-methylphenoxy)-4,6-dihydro xy-2,5-dimethyl-, methyl ester |
| CAS Registry Number |
64662-21-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H17ClO9 |
| InChI |
InChI=1S/C19H17ClO9/c1-6-11(18(25)26)17(9(5-21)15(24)12(6)20)29-16-7(2)10(19(27)28-4)13(22)8(3)14(16)23/h5,22-24H,1-4H3,(H,25,26) |
| InChIKey |
WDDQXLKSEZWXQB-UHFFFAOYSA-N |
| Molecular Weight |
424.789 g/mol |
| SMILES |
Oc1c(c(c(C(=O)O)c(c1Cl)C)Oc1c(c(C(=O)OC)c(c(c1O)C)O)C)C=O |
| SPLASH |
splash10-00m3-9214000000-4b91b9c8d92760412b18 |
| Source of Spectrum |
I-55-2842-0 |
| Synonyms |
3-Chloro-5-formyl-4-hydroxy-2-methyl-6-(3'-carbomethoxy-4',6'-dihydroxy-2',5'-dimethyl)phenoxybenzoic acid
3-Chloro-6-[2,4-dihydroxy-5-(methoxycarbonyl)-3,6-dimethylphenoxy]-5-formyl-4-hydroxy-2-methylbenzoic acid |
| Wiley ID |
1379145 |
