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(+/-)-7',8'-dihydro-trans-dehydrodiferulate dimethyl ester
SpectraBase Compound ID 3fiH0eAAhMf
InChI InChI=1S/C22H24O8/c1-26-16-11-13(6-7-15(16)23)20-19(22(25)29-4)14-9-12(5-8-18(24)28-3)10-17(27-2)21(14)30-20/h6-7,9-11,19-20,23H,5,8H2,1-4H3/t19-,20+/m1/s1
InChIKey SWBRZPBRLCJMAS-UXHICEINSA-N
Mol Weight 416.43 g/mol
Molecular Formula C22H24O8
Exact Mass 416.147118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMJ08kelbrQ
Name (+/-)-7',8'-dihydro-trans-dehydrodiferulate dimethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O8
InChI InChI=1S/C22H24O8/c1-26-16-11-13(6-7-15(16)23)20-19(22(25)29-4)14-9-12(5-8-18(24)28-3)10-17(27-2)21(14)30-20/h6-7,9-11,19-20,23H,5,8H2,1-4H3/t19-,20+/m1/s1
InChIKey SWBRZPBRLCJMAS-UXHICEINSA-N
Literature Reference DOI 10.1002/cbdv.201800134
Molecular Weight 416.426 g/mol
SMILES Oc1c(cc(cc1)[C@]1([C@@](c2c(O1)c(cc(c2)CCC(OC)=O)OC)(C(OC)=O)[H])[H])OC
SPLASH splash10-001i-1249100000-55aac7f5c39b766e1ab6
Source of Spectrum CBD-15-SM16-7
Synonyms Methyl (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-(3-methoxy-3-oxopropyl)-2,3-dihydrobenzofuran-3-carboxylate
Wiley ID 1812600