John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5QKNDV4X9Jt SpectraBase Spectrum ID=E2D2ppaIi8m

(accessed ).
Dehydrodiconiferyl diacetate
SpectraBase Compound ID 5QKNDV4X9Jt
InChI InChI=1S/C24H26O8/c1-14(25)30-9-5-6-16-10-18-19(13-31-15(2)26)23(32-24(18)22(11-16)29-4)17-7-8-20(27)21(12-17)28-3/h5-8,10-12,19,23,27H,9,13H2,1-4H3/b6-5+/t19-,23+/m0/s1
InChIKey TYXVTGSQLKCKCF-FDTLDTTQSA-N
Mol Weight 442.46 g/mol
Molecular Formula C24H26O8
Exact Mass 442.162768 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID E2D2ppaIi8m
Name Dehydrodiconiferyl diacetate
Alternate Name(s) (E)-3-((2S,3R)-3-(acetoxymethyl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl)allyl acetate Acetic acid [(E)-3-[(2S,3R)-3-(acetyloxymethyl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl]prop-2-enyl] ester [(E)-3-[(2S,3R)-3-(acetyloxymethyl)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-2,3-dihydro-1-benzofuran-5-yl]prop-2-enyl] acetate [(E)-3-[(2S,3R)-3-(acetoxymethyl)-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-2,3-dihydrobenzofuran-5-yl]allyl] acetate [(E)-3-[(2S,3R)-3-(acetyloxymethyl)-7-methoxy-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1-benzofuran-5-yl]prop-2-enyl] ethanoate
Classification 2-arylbenzofuran flavonoids
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Formula C24H26O8
InChI InChI=1S/C24H26O8/c1-14(25)30-9-5-6-16-10-18-19(13-31-15(2)26)23(32-24(18)22(11-16)29-4)17-7-8-20(27)21(12-17)28-3/h5-8,10-12,19,23,27H,9,13H2,1-4H3/b6-5+/t19-,23+/m0/s1
InChIKey TYXVTGSQLKCKCF-FDTLDTTQSA-N
SPLASH splash10-0006-9311200000-19063f5bbe8f59c27434
Source of Spectrum A1-9-489/SMS6-5 (DOI: 10.1021/ol062854f)
SpectraBase Batch ID G1xtoAYz8wd