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4,4'-Dimethoxy-.alpha.,2'-dihydroxy-.beta.-benzylsulfanyldihydrochalcone
SpectraBase Compound ID jWvTHW2L73
InChI InChI=1S/C24H24O5S/c1-28-18-10-8-17(9-11-18)24(30-15-16-6-4-3-5-7-16)23(27)22(26)20-13-12-19(29-2)14-21(20)25/h3-14,23-25,27H,15H2,1-2H3/t23-,24+/m0/s1
InChIKey HEEUWRDLOASHNG-BJKOFHAPSA-N
Mol Weight 424.51 g/mol
Molecular Formula C24H24O5S
Exact Mass 424.134445 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPyVHK6aE1w
Name 4,4'-Dimethoxy-.alpha.,2'-dihydroxy-.beta.-benzylsulfanyldihydrochalcone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H24O5S
InChI InChI=1S/C24H24O5S/c1-28-18-10-8-17(9-11-18)24(30-15-16-6-4-3-5-7-16)23(27)22(26)20-13-12-19(29-2)14-21(20)25/h3-14,23-25,27H,15H2,1-2H3/t23-,24+/m0/s1
InChIKey HEEUWRDLOASHNG-BJKOFHAPSA-N
Molecular Weight 424.511 g/mol
SMILES Oc1c(C([C@@]([C@](SCc2ccccc2)(c2ccc(cc2)OC)[H])(O)[H])=O)ccc(c1)OC
SPLASH splash10-0udi-0931000000-1759390c3497271fd543
Source of Spectrum F-53-14147-12
Synonyms (2S,3R)-3-(benzylsulfanyl)-2-hydroxy-1-(2-hydroxy-4-methoxyphenyl)-3-(4-methoxyphenyl)-1-propanone
Wiley ID 804053