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5-HYDROXY-7-(4-HYDROXY-3-METHOXYPHENYL)-1-(4-HYDROXYPHENYL)-3-HEPTANONE
SpectraBase Compound ID J3skdZouGRO
InChI InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3/t18-/m1/s1
InChIKey WAHUIEHYVBLIER-GOSISDBHSA-N
Mol Weight 344.41 g/mol
Molecular Formula C20H24O5
Exact Mass 344.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 39USTvU5KK
Name (R)-5-Hydroxy-7-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-3-heptanone
Appearance Pale yellow liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O5
InChI InChI=1S/C20H24O5/c1-25-20-12-15(6-11-19(20)24)5-10-18(23)13-17(22)9-4-14-2-7-16(21)8-3-14/h2-3,6-8,11-12,18,21,23-24H,4-5,9-10,13H2,1H3/t18-/m1/s1
InChIKey WAHUIEHYVBLIER-GOSISDBHSA-N
Instrument Name JEOL JMX-DX 302
Ionization Type EI
Literature Reference DOI 10.1021/np020099i
Molecular Weight 344.407 g/mol
Optical Rotation [a]D25 = +1.05 (c = 0.80, EtOH)
Reported Formula C20H24O5
SMILES Oc1ccc(CCC(C[C@@](CCc2cc(c(cc2)O)OC)(O)[H])=O)cc1
SPLASH splash10-052u-0905000000-b1610c5393803013c9e2
Source of Spectrum G4-65-1317-7
Wiley ID 1883862