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7-[[8-[5-CHLORO-2-(2,4-DICHLOROPHENOXY)-PHENOXY]-OCTYL]-OXY]-4-METHYL-2H-CHROMEN-2-ONE
SpectraBase Compound ID DFJq09Sn5yo
InChI InChI=1S/C30H29Cl3O5/c1-20-16-30(34)38-28-19-23(10-11-24(20)28)35-14-6-4-2-3-5-7-15-36-29-18-22(32)9-13-27(29)37-26-12-8-21(31)17-25(26)33/h8-13,16-19H,2-7,14-15H2,1H3
InChIKey JWMUZGWQJQCMLA-UHFFFAOYSA-N
Mol Weight 575.92 g/mol
Molecular Formula C30H29Cl3O5
Exact Mass 574.108057 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 83FOl8UkTtZ
Name 7-[[8-[5-CHLORO-2-(2,4-DICHLOROPHENOXY)-PHENOXY]-OCTYL]-OXY]-4-METHYL-2H-CHROMEN-2-ONE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H29Cl3O5
InChI InChI=1S/C30H29Cl3O5/c1-20-16-30(34)38-28-19-23(10-11-24(20)28)35-14-6-4-2-3-5-7-15-36-29-18-22(32)9-13-27(29)37-26-12-8-21(31)17-25(26)33/h8-13,16-19H,2-7,14-15H2,1H3
InChIKey JWMUZGWQJQCMLA-UHFFFAOYSA-N
Literature Reference Author E.OTERO,S.VERGARA,S.M.ROBLEDO,W.CARDONA,M.CARDA,I.D.VELEZ,C. ROJAS,F.OTALVARO
Literature Reference Citation MOLECULES,19,13251(2014)
Literature Reference DOI 10.3390/molecules190913251
Molecular Weight 575.916 g/mol
Solvent CDCl3
Source File Reference UWIR15131