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3,4,4,6'-Tetramethoxy-.alpha.,2'-dihydroxy-.beta.-benzylsulfanyldihydrochalcone
SpectraBase Compound ID 21JaGOgBzw6
InChI InChI=1S/C26H28O7S/c1-30-18-13-19(27)23(22(14-18)33-4)24(28)25(29)26(34-15-16-8-6-5-7-9-16)17-10-11-20(31-2)21(12-17)32-3/h5-14,25-27,29H,15H2,1-4H3/t25-,26+/m0/s1
InChIKey DYDMNAKHMPCMFQ-IZZNHLLZSA-N
Mol Weight 484.56 g/mol
Molecular Formula C26H28O7S
Exact Mass 484.155574 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nJK145Y8Jn
Name 3,4,4,6'-Tetramethoxy-.alpha.,2'-dihydroxy-.beta.-benzylsulfanyldihydrochalcone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H28O7S
InChI InChI=1S/C26H28O7S/c1-30-18-13-19(27)23(22(14-18)33-4)24(28)25(29)26(34-15-16-8-6-5-7-9-16)17-10-11-20(31-2)21(12-17)32-3/h5-14,25-27,29H,15H2,1-4H3/t25-,26+/m0/s1
InChIKey DYDMNAKHMPCMFQ-IZZNHLLZSA-N
Molecular Weight 484.563 g/mol
SMILES O[C@@](C(c1c(cc(cc1OC)OC)O)=O)([C@@](c1cc(OC)c(cc1)OC)(SCc1ccccc1)[H])[H]
SPLASH splash10-0f89-0913000000-c1903e394aecfa296c9e
Source of Spectrum F-53-14148-15
Synonyms (2S,3R)-3-(benzylsulfanyl)-3-(3,4-dimethoxyphenyl)-2-hydroxy-1-(2-hydroxy-4,6-dimethoxyphenyl)-1-propanone
Wiley ID 804050