![11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester](/api/spectrum/KjrHVdzXnsN/structure.png?h=300&w=458 "11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester")
| SpectraBase Compound ID | L3fB1afj2u4 |
|---|---|
| InChI | InChI=1S/C20H20O7/c1-8-7-12(24-5)9(2)16-13(8)20(23)27-18-11(4)15(21)14(19(22)25-6)10(3)17(18)26-16/h7,21H,1-6H3 |
| InChIKey | GBAQJUAXTCJTDK-UHFFFAOYSA-N |
| Mol Weight | 372.37 g/mol |
| Molecular Formula | C20H20O7 |
| Exact Mass | 372.120903 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KjrHVdzXnsN |
|---|---|
| Name | 11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester |
| CAS Registry Number | 6161-70-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H20O7 |
| InChI | InChI=1S/C20H20O7/c1-8-7-12(24-5)9(2)16-13(8)20(23)27-18-11(4)15(21)14(19(22)25-6)10(3)17(18)26-16/h7,21H,1-6H3 |
| InChIKey | GBAQJUAXTCJTDK-UHFFFAOYSA-N |
| Molecular Weight | 372.373 g/mol |
| SMILES | Oc1c(C)c2c(c(C)c1C(=O)OC)Oc1c(C)c(cc(C)c1C(=O)O2)OC |
| SPLASH | splash10-03k9-0009000000-8929e2620cb81e8d08d6 |
| Source of Spectrum | I-55-2844-0 |
| Synonyms | Methyl 8-hydroxy-3-methoxy-1,4,6,9-tetramethyl-11-oxo-11H-dibenzo[b,E][1,4]dioxepine-7-carboxylate 3-Hydroxy-6-keto-9-methoxy-1,4,7,10-tetramethyl-benzo[b][1,4]benzodioxepin-2-carboxylic acid methyl ester 3-Hydroxy-9-methoxy-1,4,7,10-tetramethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester Benzoic acid, 4',6'-dihydroxy-4-methoxy-2',3,5',6-tetramethyl-2,3'-oxydi-, .epsilon.-lactone, methyl ester Methyl 3-hydroxy-9-methoxy-1,4,7,10-tetramethyl-6-oxo-benzo[b][1,4]benzodioxepine-2-carboxylate Methyl 9-methoxy-1,4,7,10-tetramethyl-3-oxidanyl-6-oxidanylidene-benzo[b][1,4]benzodioxepine-2-carboxylate |
| Wiley ID | 1355383 |