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2-(6'-CARBOMETHOXYHEXYL)-3-(E-1''-OCTEN-3'',7''-DIOLYL)-CYCLOPENTANONE
SpectraBase Compound ID ATZ0KaCsqp0
InChI InChI=1S/C21H36O5/c1-16(22)8-7-9-18(23)14-12-17-13-15-20(24)19(17)10-5-3-4-6-11-21(25)26-2/h12,14,16-19,22-23H,3-11,13,15H2,1-2H3/b14-12+
InChIKey WSFLATNWUZPZOH-WYMLVPIESA-N
Mol Weight 368.5 g/mol
Molecular Formula C21H36O5
Exact Mass 368.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ccx5DdugTLw
Name 2-(6'-CARBOMETHOXYHEXYL)-3-(E-1''-OCTEN-3'',7''-DIOLYL)-CYCLOPENTANONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H36O5
InChI InChI=1S/C21H36O5/c1-16(22)8-7-9-18(23)14-12-17-13-15-20(24)19(17)10-5-3-4-6-11-21(25)26-2/h12,14,16-19,22-23H,3-11,13,15H2,1-2H3/b14-12+
InChIKey WSFLATNWUZPZOH-WYMLVPIESA-N
Literature Reference Author H.L.HOLLAND,F.M.BROWN,P.C.CHENCHAIAH,J.A.RAO
Literature Reference Citation CAN.J.CHEM.,68,282(1990)
Literature Reference DOI 10.1139/v90-039
Molecular Weight 368.514 g/mol
Solvent CDCl3
Source File Reference UWED15059