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(E)-tert-Butyl 2-chloro-4-methyl-3-(trifluoromethyl)hex-2-enoate
SpectraBase Compound ID 2HoRH99leYz
InChI InChI=1S/C12H18ClF3O2/c1-6-7(2)8(12(14,15)16)9(13)10(17)18-11(3,4)5/h7H,6H2,1-5H3/b9-8+
InChIKey WZRICPKRFMNSFT-CMDGGOBGSA-N
Mol Weight 286.72 g/mol
Molecular Formula C12H18ClF3O2
Exact Mass 286.094742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 23gbXjmZ4dT
Name (E)-tert-Butyl 2-chloro-4-methyl-3-(trifluoromethyl)hex-2-enoate
Alternate Name(s) tert-Butyl (2E)-2-chloro-4-methyl-3-(trifluoromethyl)-2-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18ClF3O2
InChI InChI=1S/C12H18ClF3O2/c1-6-7(2)8(12(14,15)16)9(13)10(17)18-11(3,4)5/h7H,6H2,1-5H3/b9-8+
InChIKey WZRICPKRFMNSFT-CMDGGOBGSA-N
Molecular Weight 286.722 g/mol
SMILES C(\C(=C\(C(CC)C)C(F)(F)F)Cl)(=O)OC(C)(C)C
SPLASH splash10-0a4i-9060000000-46d378ab1aec4c501ba8
Source of Spectrum KC-0-2532-4
Wiley ID 786584