| SpectraBase Spectrum ID |
LPUGGukRrgB |
| Name |
Benzoic acid, 3-chloro-4,6-dihydroxy-2,5-dimethyl-, ethyl ester |
| CAS Registry Number |
57074-25-6 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H13ClO4 |
| InChI |
InChI=1S/C11H13ClO4/c1-4-16-11(15)7-5(2)8(12)10(14)6(3)9(7)13/h13-14H,4H2,1-3H3 |
| InChIKey |
FOBOHPQHGJSWBL-UHFFFAOYSA-N |
| Molecular Weight |
244.674 g/mol |
| SMILES |
Oc1c(c(c(c(c1C)O)C(=O)OCC)C)Cl |
| SPLASH |
splash10-0002-0950000000-b870ce5897b40dcd882d |
| Source of Spectrum |
B-40-1585-11 |
| Synonyms |
Ethyl 3-chloro-4,6-dihydroxy-2,5-dimethylbenzoate
5-chloro-2,4-dihydroxy-3,6-dimethylbenzoic acid ethyl ester
ethyl 5-chloro-2,4-dihydroxy-3,6-dimethylbenzoate
ethyl 5-chloro-2,4-dihydroxy-3,6-dimethyl-benzoate
ethyl 3-chloranyl-2,5-dimethyl-4,6-bis(oxidanyl)benzoate |
| Wiley ID |
1246632 |
