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ETHYL-(E)-8-CHLORO-7,7-DIFLUORO-8-(4-METHOXYPHENYLIMINO)-2-OCTENOATE
SpectraBase Compound ID 3x35AwUY9IU
InChI InChI=1S/C17H20ClF2NO3/c1-3-24-15(22)7-5-4-6-12-17(19,20)16(18)21-13-8-10-14(23-2)11-9-13/h5,7-11H,3-4,6,12H2,1-2H3/b7-5+,21-16-
InChIKey PBKADWGRYTUPIT-OQVQMETOSA-N
Mol Weight 359.8 g/mol
Molecular Formula C17H20ClF2NO3
Exact Mass 359.109978 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID MsIOIAGyFC
Name ETHYL-(E)-8-CHLORO-7,7-DIFLUORO-8-(4-METHOXYPHENYLIMINO)-2-OCTENOATE
Compound Number 5C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20ClF2NO3
InChI InChI=1S/C17H20ClF2NO3/c1-3-24-15(22)7-5-4-6-12-17(19,20)16(18)21-13-8-10-14(23-2)11-9-13/h5,7-11H,3-4,6,12H2,1-2H3/b7-5+,21-16-
InChIKey PBKADWGRYTUPIT-OQVQMETOSA-N
Literature Reference Author S.FUSTERO,M.SANCHEZ-ROSELLO,J.F.SANZ-CERVERA,J.L.ACENA,C.D.P OZO,B.FERNANDEZ,A.BA
Literature Reference Citation ORG.LETTERS,8,4633(2006)
Literature Reference DOI 10.1021/ol061892w
Molecular Weight 359.801 g/mol
Sample ID 61685
Solvent CDCl3