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3-[(R)-1,3-benzodioxol-5-yl(hydroxy)methyl]-4-veratryl-2H-furan-5-one
SpectraBase Compound ID Aujwt9zs8u0
InChI InChI=1S/C21H20O7/c1-24-16-5-3-12(8-18(16)25-2)7-14-15(10-26-21(14)23)20(22)13-4-6-17-19(9-13)28-11-27-17/h3-6,8-9,20,22H,7,10-11H2,1-2H3/t20-/m1/s1
InChIKey CYZBGDXPWCEWCM-HXUWFJFHSA-N
Mol Weight 384.38 g/mol
Molecular Formula C21H20O7
Exact Mass 384.120903 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3AK0WFyOw1O
Name 3-[(R)-1,3-benzodioxol-5-yl(hydroxy)methyl]-4-veratryl-2H-furan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20O7
InChI InChI=1S/C21H20O7/c1-24-16-5-3-12(8-18(16)25-2)7-14-15(10-26-21(14)23)20(22)13-4-6-17-19(9-13)28-11-27-17/h3-6,8-9,20,22H,7,10-11H2,1-2H3/t20-/m1/s1
InChIKey CYZBGDXPWCEWCM-HXUWFJFHSA-N
Molecular Weight 384.384 g/mol
SMILES O[C@@](C1=C(C(=O)OC1)Cc1cc(OC)c(cc1)OC)(c1cc2OCOc2cc1)[H]
SPLASH splash10-0udi-0910000000-c5adf56b2a59941eb6d6
Source of Spectrum X2-56-1180-1
Synonyms 3-[(R)-1,3-benzodioxol-5-yl(hydroxy)methyl]-4-[(3,4-dimethoxyphenyl)methyl]-2H-furan-5-one 3-[(R)-1,3-benzodioxol-5-yl(oxidanyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]-2H-furan-5-one
Wiley ID 1604992