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1-(2,4,6-Trihydroxyphenyl)-3-[3-hydroxy-4-methoxy-6-(methoxycarbonyl)phenyl]propanone
SpectraBase Compound ID DUAEHmeJWqf
InChI InChI=1S/C18H18O8/c1-25-16-8-11(18(24)26-2)9(5-13(16)21)3-4-12(20)17-14(22)6-10(19)7-15(17)23/h5-8,19,21-23H,3-4H2,1-2H3
InChIKey DBJRVLWPIYMLSM-UHFFFAOYSA-N
Mol Weight 362.33 g/mol
Molecular Formula C18H18O8
Exact Mass 362.100168 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6OxnLpoq8wj
Name 1-(2,4,6-Trihydroxyphenyl)-3-[3-hydroxy-4-methoxy-6-(methoxycarbonyl)phenyl]propanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O8
InChI InChI=1S/C18H18O8/c1-25-16-8-11(18(24)26-2)9(5-13(16)21)3-4-12(20)17-14(22)6-10(19)7-15(17)23/h5-8,19,21-23H,3-4H2,1-2H3
InChIKey DBJRVLWPIYMLSM-UHFFFAOYSA-N
Molecular Weight 362.334 g/mol
SMILES Oc1cc(cc(c1C(CCc1c(cc(c(c1)O)OC)C(=O)OC)=O)O)O
SPLASH splash10-0udi-0901000000-ef985ada8c32c698e40b
Source of Spectrum O-26-45-11
Synonyms Methyl 4-hydroxy-5-methoxy-2-[3-oxo-3-(2,4,6-trihydroxyphenyl)propyl]benzoate
Wiley ID 1349435