| SpectraBase Spectrum ID |
6ZQsWf5Hlnj |
| Name |
11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-11-oxo-1,6-dipropyl-, methyl ester |
| CAS Registry Number |
113487-87-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H24O7 |
| InChI |
InChI=1S/C22H24O7/c1-5-7-12-9-13(26-3)10-16-18(12)22(25)29-17-11-15(23)19(21(24)27-4)14(8-6-2)20(17)28-16/h9-11,23H,5-8H2,1-4H3 |
| InChIKey |
KSQHYNDVJIKFME-UHFFFAOYSA-N |
| Molecular Weight |
400.427 g/mol |
| SMILES |
Oc1c(C(=O)OC)c(c2c(OC(c3c(O2)cc(cc3CCC)OC)=O)c1)CCC |
| SPLASH |
splash10-0wou-0009300000-0d440a9746bacff0518a |
| Source of Spectrum |
B-40-1464-26 |
| Synonyms |
Methyl 8-hydroxy-3-methoxy-1,6-dipropyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylate (methyl divauonate)
Methyl 8-hydroxy-3-methoxy-11-oxo-1,6-dipropyl-11H-dibenzo[b,e][1,4]dioxepin-7-carboxylate |
| Wiley ID |
1369400 |
![11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-11-oxo-1,6-dipropyl-, methyl ester](/api/spectrum/6ZQsWf5Hlnj/structure.png?h=300&w=458 "11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-11-oxo-1,6-dipropyl-, methyl ester")
