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11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-1,4,6-trimethyl-11-oxo-, methyl ester
SpectraBase Compound ID D4qt2qVgdoa
InChI InChI=1S/C19H18O7/c1-8-6-12(23-4)9(2)17-14(8)19(22)25-13-7-11(20)15(18(21)24-5)10(3)16(13)26-17/h6-7,20H,1-5H3
InChIKey TXLRRTYAEXHCQV-UHFFFAOYSA-N
Mol Weight 358.35 g/mol
Molecular Formula C19H18O7
Exact Mass 358.105253 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1rJ8Wjj2xdc
Name 11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 8-hydroxy-3-methoxy-1,4,6-trimethyl-11-oxo-, methyl ester
CAS Registry Number 38629-30-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18O7
InChI InChI=1S/C19H18O7/c1-8-6-12(23-4)9(2)17-14(8)19(22)25-13-7-11(20)15(18(21)24-5)10(3)16(13)26-17/h6-7,20H,1-5H3
InChIKey TXLRRTYAEXHCQV-UHFFFAOYSA-N
Molecular Weight 358.346 g/mol
SMILES Oc1cc2c(c(C)c1C(=O)OC)Oc1c(C)c(cc(C)c1C(=O)O2)OC
SPLASH splash10-0a7j-3497000000-39362422d0c8d3531e50
Source of Spectrum B-25-2178-9
Synonyms Methyl 8-hydroxy-3-methoxy-1,4,6-trimethyl-11-oxo-11H-dibenzo[b,E][1,4]dioxepine-7-carboxylate 3-Hydroxy-6-keto-9-methoxy-1,7,10-trimethyl-benzo[b][1,4]benzodioxepin-2-carboxylic acid methyl ester 3-Hydroxy-9-methoxy-1,7,10-trimethyl-6-oxo-2-benzo[b][1,4]benzodioxepincarboxylic acid methyl ester Methyl 3-hydroxy-9-methoxy-1,7,10-trimethyl-6-oxo-benzo[b][1,4]benzodioxepine-2-carboxylate Methyl 9-methoxy-1,7,10-trimethyl-3-oxidanyl-6-oxidanylidene-benzo[b][1,4]benzodioxepine-2-carboxylate
Wiley ID 1346956