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7-Difluoromethoxy-5,4'-di-n-octyloxygenistein
SpectraBase Compound ID EXRVS7vcQWX
InChI InChI=1S/C32H42F2O5/c1-3-5-7-9-11-13-19-36-25-17-15-24(16-18-25)27-23-38-29-22-26(39-32(33)34)21-28(30(29)31(27)35)37-20-14-12-10-8-6-4-2/h15-18,21-23,32H,3-14,19-20H2,1-2H3
InChIKey NFKKPCJWXNGYKG-UHFFFAOYSA-N
Mol Weight 544.7 g/mol
Molecular Formula C32H42F2O5
Exact Mass 544.300031 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I1wwK38An6Y
Name 7-Difluoromethoxy-5,4'-di-n-octyloxygenistein
Appearance Light yellow powder
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H42F2O5
InChI InChI=1S/C32H42F2O5/c1-3-5-7-9-11-13-19-36-25-17-15-24(16-18-25)27-23-38-29-22-26(39-32(33)34)21-28(30(29)31(27)35)37-20-14-12-10-8-6-4-2/h15-18,21-23,32H,3-14,19-20H2,1-2H3
InChIKey NFKKPCJWXNGYKG-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 544.680 g/mol
SMILES C(CCCCCCC)Oc1c2c(cc(c1)OC(F)F)OC=C(C2=O)c1ccc(cc1)OCCCCCCCC
SPLASH splash10-0002-2001900000-845562869e0efb97db2a
Source of Spectrum CN103073531A
Wiley ID 1876993