| SpectraBase Spectrum ID |
BrT88nqwYu4 |
| Name |
11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2-chloro-4-formyl-8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-, methyl ester |
| CAS Registry Number |
64662-20-0 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H17ClO8 |
| InChI |
InChI=1S/C20H17ClO8/c1-7-12-17(10(6-22)18(26-4)13(7)21)28-15-8(2)11(19(24)27-5)14(23)9(3)16(15)29-20(12)25/h6,23H,1-5H3 |
| InChIKey |
HZCDZFWYCRSJPT-UHFFFAOYSA-N |
| Molecular Weight |
420.801 g/mol |
| SMILES |
Oc1c(c2OC(c3c(c(C=O)c(c(c3C)Cl)OC)Oc2c(c1C(=O)OC)C)=O)C |
| SPLASH |
splash10-0229-2009400000-6c88ead0464c604c4a39 |
| Source of Spectrum |
I-55-2842-0 |
| Synonyms |
Methyl 2-chloro-4-formyl-8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylate |
| Wiley ID |
1377834 |
![11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2-chloro-4-formyl-8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-, methyl ester](/api/spectrum/BrT88nqwYu4/structure.png?h=300&w=458 "11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 2-chloro-4-formyl-8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-, methyl ester")
