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(3R,4R)-3-[(4-keto-1-methoxy-cyclohexa-2,5-dien-1-yl)methyl]-4-veratryl-tetrahydrofuran-2-one
SpectraBase Compound ID 7p4fgMBaYgV
InChI InChI=1S/C21H24O6/c1-24-18-5-4-14(11-19(18)25-2)10-15-13-27-20(23)17(15)12-21(26-3)8-6-16(22)7-9-21/h4-9,11,15,17H,10,12-13H2,1-3H3/t15-,17+/m0/s1
InChIKey QOOWFMOCBNIGIF-DOTOQJQBSA-N
Mol Weight 372.42 g/mol
Molecular Formula C21H24O6
Exact Mass 372.157288 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6APuZGZlQzD
Name (3R,4R)-3-[(4-keto-1-methoxy-cyclohexa-2,5-dien-1-yl)methyl]-4-veratryl-tetrahydrofuran-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O6
InChI InChI=1S/C21H24O6/c1-24-18-5-4-14(11-19(18)25-2)10-15-13-27-20(23)17(15)12-21(26-3)8-6-16(22)7-9-21/h4-9,11,15,17H,10,12-13H2,1-3H3/t15-,17+/m0/s1
InChIKey QOOWFMOCBNIGIF-DOTOQJQBSA-N
Molecular Weight 372.417 g/mol
SMILES C1([C@@]([C@@](Cc2cc(OC)c(cc2)OC)(CO1)[H])(CC1(C=CC(C=C1)=O)OC)[H])=O
SPLASH splash10-0udi-0902000000-75c94ccf58b6dfc9270e
Source of Spectrum F-52-1330-25
Synonyms (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(1-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-yl)methyl]oxolan-2-one (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(1-methoxy-4-oxo-1-cyclohexa-2,5-dienyl)methyl]-2-oxolanone (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(1-methoxy-4-oxo-cyclohexa-2,5-dien-1-yl)methyl]tetrahydrofuran-2-one (3R,4R)-4-[(3,4-dimethoxyphenyl)methyl]-3-[(1-methoxy-4-oxocyclohexa-2,5-dien-1-yl)methyl]oxolan-2-one
Wiley ID 794856