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11H-Dibenzo[b,e][1,4]dioxepin-7-carboxylic acid, 3,8-dihydroxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester
SpectraBase Compound ID BMWQ03VgGIK
InChI InChI=1S/C19H18O7/c1-7-6-11(20)8(2)15-12(7)19(23)26-17-10(4)14(21)13(18(22)24-5)9(3)16(17)25-15/h6,20-21H,1-5H3
InChIKey SOHAFBHCOPECDB-UHFFFAOYSA-N
Mol Weight 358.35 g/mol
Molecular Formula C19H18O7
Exact Mass 358.105253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KXlVus7HlGk
Name 11H-Dibenzo[B,E][1,4]dioxepin-7-carboxylic acid, 3,8-dihydroxy-1,4,6,9-tetramethyl-11-oxo-, methyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.105252913 u
Formula C19H18O7
InChI InChI=1S/C19H18O7/c1-7-6-11(20)8(2)15-12(7)19(23)26-17-10(4)14(21)13(18(22)24-5)9(3)16(17)25-15/h6,20-21H,1-5H3
InChIKey SOHAFBHCOPECDB-UHFFFAOYSA-N
Molecular Weight 358.346 g/mol
SMILES C1(C)=C2C(=C(C(=C1C(OC)=O)O)C)OC(=O)C1=C(O2)C(C)=C(O)C=C1C