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3',7-dihydroxy-4'-methoxyflavane
SpectraBase Compound ID DPKBFncsZt3
InChI InChI=1S/C16H16O4/c1-19-15-7-4-11(8-13(15)18)14-6-3-10-2-5-12(17)9-16(10)20-14/h2,4-5,7-9,14,17-18H,3,6H2,1H3
InChIKey KGTOSQKIOMIICT-UHFFFAOYSA-N
Mol Weight 272.3 g/mol
Molecular Formula C16H16O4
Exact Mass 272.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7MRUKiR0sA
Name 3',7-dihydroxy-4'-methoxyflavane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O4
InChI InChI=1S/C16H16O4/c1-19-15-7-4-11(8-13(15)18)14-6-3-10-2-5-12(17)9-16(10)20-14/h2,4-5,7-9,14,17-18H,3,6H2,1H3
InChIKey KGTOSQKIOMIICT-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 272.300 g/mol
SMILES Oc1cc(C2Oc3c(ccc(c3)O)CC2)ccc1OC
SPLASH splash10-0fki-0940000000-d7f8868a34c135e57ad8
Sample Comments Racemic mixture
Source of Spectrum EP2253226A1
Wiley ID 1843951