| SpectraBase Spectrum ID |
9huKOv6IkjB |
| Name |
11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2-chloro-3,8-dihydroxy-4-(hydroxymethyl)-1,6,9-trimethyl-11-oxo-, methyl ester |
| CAS Registry Number |
64662-24-4 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H17ClO8 |
| InChI |
InChI=1S/C19H17ClO8/c1-6-11-17(9(5-21)14(23)12(6)20)27-15-7(2)10(18(24)26-4)13(22)8(3)16(15)28-19(11)25/h21-23H,5H2,1-4H3 |
| InChIKey |
WHVGZQBAXYTPJB-UHFFFAOYSA-N |
| Molecular Weight |
408.790 g/mol |
| SMILES |
OCc1c2c(c(c(c1O)Cl)C)C(Oc1c(c(c(c(c1O2)C)C(=O)OC)O)C)=O |
| SPLASH |
splash10-000i-9024000000-557c841f232648414fa7 |
| Source of Spectrum |
I-55-2843-0 |
| Synonyms |
Methyl 2-chloro-3,8-dihydroxy-4-(hydroxymethyl)-1,6,9-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylate |
| Wiley ID |
1372801 |
![11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2-chloro-3,8-dihydroxy-4-(hydroxymethyl)-1,6,9-trimethyl-11-oxo-, methyl ester](/api/spectrum/9huKOv6IkjB/structure.png?h=300&w=458 "11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2-chloro-3,8-dihydroxy-4-(hydroxymethyl)-1,6,9-trimethyl-11-oxo-, methyl ester")
