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(2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
SpectraBase Compound ID IvwcXYEeDZI
InChI InChI=1S/C17H16O6/c1-21-14-7-11(3-4-12(14)20)17-16(9-19)22-15-6-10(8-18)2-5-13(15)23-17/h2-8,16-17,19-20H,9H2,1H3/t16-,17-/m1/s1
InChIKey FLRLIXJCEWUHRR-IAGOWNOFSA-N
Mol Weight 316.31 g/mol
Molecular Formula C17H16O6
Exact Mass 316.094688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzCKbGIuEGt
Name (2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
Alternate Name(s) (2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-3-methylol-2,3-dihydro-1,4-benzodioxin-6-carbaldehyde (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-3-(hydroxymethyl)-2,3-dihydro-1,4-benzodioxin-6-carboxaldehyde (2R,3R)-3-(hydroxymethyl)-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde
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Formula C17H16O6
InChI InChI=1S/C17H16O6/c1-21-14-7-11(3-4-12(14)20)17-16(9-19)22-15-6-10(8-18)2-5-13(15)23-17/h2-8,16-17,19-20H,9H2,1H3/t16-,17-/m1/s1
InChIKey FLRLIXJCEWUHRR-IAGOWNOFSA-N
Molecular Weight 316.309 g/mol
SMILES OC[C@]1(Oc2c(O[C@@]1(c1ccc(c(c1)OC)O)[H])ccc(c2)C=O)[H]
SPLASH splash10-00li-0923000000-8e931763df9354eac10d
Source of Spectrum KD-14-704-9
Wiley ID 1635963