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4-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-3-hydroxy-1-(4-methoxyphenyl)-1-butanone
SpectraBase Compound ID L9Hx4mES2WC
InChI InChI=1S/C20H22O7/c1-23-15-6-4-12(5-7-15)16(22)10-14(21)8-13-9-17-19(27-11-26-17)20(25-3)18(13)24-2/h4-7,9,14,21H,8,10-11H2,1-3H3
InChIKey YIBVGVZIZZRQPP-UHFFFAOYSA-N
Mol Weight 374.39 g/mol
Molecular Formula C20H22O7
Exact Mass 374.136553 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22smXzRpc9z
Name 4-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)-3-hydroxy-1-(4-methoxyphenyl)-1-butanone
Appearance White-yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22O7
InChI InChI=1S/C20H22O7/c1-23-15-6-4-12(5-7-15)16(22)10-14(21)8-13-9-17-19(27-11-26-17)20(25-3)18(13)24-2/h4-7,9,14,21H,8,10-11H2,1-3H3
InChIKey YIBVGVZIZZRQPP-UHFFFAOYSA-N
Instrument Name Finnigan MAT INCOS 50
Ionization Type EI
Literature Reference DOI 10.1021/acs.jnatprod.5b01007
Molecular Weight 374.389 g/mol
SMILES OC(Cc1c(c(c2c(c1)OCO2)OC)OC)CC(c1ccc(cc1)OC)=O
SPLASH splash10-055k-2911000000-d833e9271555864e3440
Source of Spectrum G4-79-926-3e
Wiley ID 1849298