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3trans-(3,4-Dimethoxyphenyl)-2rel-hydroxymethyl-1,4-benzodioxane
SpectraBase Compound ID 9iaw73ZYQYY
InChI InChI=1S/C17H18O5/c1-19-12-8-7-11(9-15(12)20-2)17-16(10-18)21-13-5-3-4-6-14(13)22-17/h3-9,16-18H,10H2,1-2H3/t16-,17-/m1/s1
InChIKey AXSYIROZFKPEIA-IAGOWNOFSA-N
Mol Weight 302.33 g/mol
Molecular Formula C17H18O5
Exact Mass 302.115424 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CSjLh6t7GFK
Name 3trans-(3,4-Dimethoxyphenyl)-2rel-hydroxymethyl-1,4-benzodioxane
Alternate Name(s) ((2R,3R)-3-(3,4-dimethoxyphenyl)-2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methanol
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Formula C17H18O5
InChI InChI=1S/C17H18O5/c1-19-12-8-7-11(9-15(12)20-2)17-16(10-18)21-13-5-3-4-6-14(13)22-17/h3-9,16-18H,10H2,1-2H3/t16-,17-/m1/s1
InChIKey AXSYIROZFKPEIA-IAGOWNOFSA-N
Literature Reference DOI 10.1002/cber.19751080517
Molecular Weight 302.326 g/mol
SMILES OC[C@]1(Oc2c(cccc2)O[C@@]1(c1ccc(c(c1)OC)OC)[H])[H]
SPLASH splash10-0udi-0923000000-f1419fc5ee50473b875c
Source of Spectrum K-108-1494-20
Wiley ID 1793898