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Caruilignan D
SpectraBase Compound ID DVeuAleq4DK
InChI InChI=1S/C14H16O6/c1-17-10-3-7(4-11(18-2)12(10)15)13-8-5-20-14(16)9(8)6-19-13/h3-4,8-9,13,15H,5-6H2,1-2H3/t8-,9-,13-/m0/s1
InChIKey AUXYOVQIZNPKSO-RVBZMBCESA-N
Mol Weight 280.28 g/mol
Molecular Formula C14H16O6
Exact Mass 280.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IdYYGvZG41I
Name Caruilignan D
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O6
InChI InChI=1S/C14H16O6/c1-17-10-3-7(4-11(18-2)12(10)15)13-8-5-20-14(16)9(8)6-19-13/h3-4,8-9,13,15H,5-6H2,1-2H3/t8-,9-,13-/m0/s1
InChIKey AUXYOVQIZNPKSO-RVBZMBCESA-N
Molecular Weight 280.276 g/mol
SMILES Oc1c(cc([C@]2([C@@]3([C@@](C(OC3)=O)(CO2)[H])[H])[H])cc1OC)OC
SPLASH splash10-001i-0940000000-e1af0722c9fd8ed8bde1
Source of Spectrum E2-49-186-5
Synonyms (3R,3aR,6aR)-3-(4-hydroxy-3,5-dimethoxyphenyl)-3,3a,4,6a-tetrahydro-1H-furo[3,4-c]furan-6-one (3R,3aR,6aR)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)-3,3a,4,6a-tetrahydro-1H-furo[3,4-c]furan-6-one
Wiley ID 1555656