![11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 3,8-dimethoxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester](/api/spectrum/I4tA0M6UEw8/structure.png?h=300&w=458 "11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 3,8-dimethoxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester")
| SpectraBase Compound ID | 5PMX5BoBDaM |
|---|---|
| InChI | InChI=1S/C21H22O7/c1-9-8-13(24-5)10(2)17-14(9)21(23)28-19-12(4)16(25-6)15(20(22)26-7)11(3)18(19)27-17/h8H,1-7H3 |
| InChIKey | HJOIJGXPJAWTJZ-UHFFFAOYSA-N |
| Mol Weight | 386.4 g/mol |
| Molecular Formula | C21H22O7 |
| Exact Mass | 386.136553 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | I4tA0M6UEw8 |
|---|---|
| Name | 11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 3,8-dimethoxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester |
| CAS Registry Number | 4723-32-4 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H22O7 |
| InChI | InChI=1S/C21H22O7/c1-9-8-13(24-5)10(2)17-14(9)21(23)28-19-12(4)16(25-6)15(20(22)26-7)11(3)18(19)27-17/h8H,1-7H3 |
| InChIKey | HJOIJGXPJAWTJZ-UHFFFAOYSA-N |
| Molecular Weight | 386.400 g/mol |
| SMILES | Cc1cc(c(C)c2c1C(=O)Oc1c(C)c(c(c(C)c1O2)C(=O)OC)OC)OC |
| SPLASH | splash10-0buc-3549000000-8a62b7e89a7d5699b0fc |
| Source of Spectrum | SD-1981-0-0 |
| Synonyms | Methyl 3,8-dimethoxy-1,4,6,9-tetramethyl-11-oxo-11H-dibenzo[b,E][1,4]dioxepine-7-carboxylate 3,9-Dimethoxy-1,4,7,10-tetramethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester 6-keto-3,9-dimethoxy-1,4,7,10-tetramethyl-benzo[b][1,4]benzodioxepin-2-carboxylic acid methyl ester Methyl 3,9-dimethoxy-1,4,7,10-tetramethyl-6-oxidanylidene-benzo[b][1,4]benzodioxepine-2-carboxylate Methyl 3,9-dimethoxy-1,4,7,10-tetramethyl-6-oxo-benzo[b][1,4]benzodioxepine-2-carboxylate |
| Wiley ID | 55803 |