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Ethyl (Z)-3-(difluoromethyl)-7-methylocta-2,6-dienoate
SpectraBase Compound ID KvWbYsTxhSB
InChI InChI=1S/C12H18F2O2/c1-3-5-6-7-8-10(12(13)14)9-11(15)16-4-2/h5-6,9,12H,3-4,7-8H2,1-2H3/b6-5+,10-9-
InChIKey SZURRPAWQMMTIY-QMRMAQATSA-N
Mol Weight 232.27 g/mol
Molecular Formula C12H18F2O2
Exact Mass 232.127486 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Htvn3legbnf
Name ETHYL-(Z)-3-(DIFLUOROMETHYL)-7-METHYLOCTA-2,6-DIENOATE
CAS Registry Number 76480-97-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18F2O2
InChI InChI=1S/C12H18F2O2/c1-3-5-6-7-8-10(12(13)14)9-11(15)16-4-2/h5-6,9,12H,3-4,7-8H2,1-2H3/b6-5+,10-9-
InChIKey SZURRPAWQMMTIY-QMRMAQATSA-N
Literature Reference Author C.D.POULTER,P.L.WIGGINS,T.L.PLUMMER
Literature Reference Citation J.ORG.CHEM.,46,1532(1981)
Literature Reference DOI 10.1021/jo00321a003
Solvent CDCl3
Source File Reference UWPS534