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11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-
SpectraBase Compound ID 5g75PbYl3YC
InChI InChI=1S/C18H16O6/c1-8-6-13(22-4)11(7-19)17-14(8)18(21)24-16-10(3)12(20)5-9(2)15(16)23-17/h5-7,20H,1-4H3
InChIKey XEAMACWRFNVXTF-UHFFFAOYSA-N
Mol Weight 328.32 g/mol
Molecular Formula C18H16O6
Exact Mass 328.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7U8Q8CvFRKD
Name 11H-Dibenzo[b,e][1,4]dioxepin-4-carboxaldehyde, 8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-
CAS Registry Number 84592-18-7
Comments Less than 3 mono-isotopic peaks
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Formula C18H16O6
InChI InChI=1S/C18H16O6/c1-8-6-13(22-4)11(7-19)17-14(8)18(21)24-16-10(3)12(20)5-9(2)15(16)23-17/h5-7,20H,1-4H3
InChIKey XEAMACWRFNVXTF-UHFFFAOYSA-N
Molecular Weight 328.320 g/mol
SMILES Oc1cc(c2c(c1C)OC(c1c(O2)c(c(cc1C)OC)C=O)=O)C
SPLASH splash10-004i-0109000000-e2ea766303885e6a1028
Source of Spectrum B-35-2331-0
Synonyms 8-Hydroxy-3-methoxy-1,6,8-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carbaldehyde 8-hydroxy-3-methoxy-1,6,9-trimethyl-11-oxo-11H-dibenzo[b,e][1,4]dioxepin-4-carbaldehyde
Wiley ID 1326212