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Ethyl (1-(4-(trifluoromethyl)phenyl)but-2-en-1-yl)carbonate
SpectraBase Compound ID qEKtsYqx8l
InChI InChI=1S/C14H15F3O3/c1-3-5-12(20-13(18)19-4-2)10-6-8-11(9-7-10)14(15,16)17/h3,5-9,12H,4H2,1-2H3
InChIKey IALJWIPKIQTGHU-UHFFFAOYSA-N
Mol Weight 288.27 g/mol
Molecular Formula C14H15F3O3
Exact Mass 288.097329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbGMk3Lzh1E
Name Ethyl (1-(4-(trifluoromethyl)phenyl)but-2-en-1-yl)carbonate
Appearance Yellow oil
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Formula C14H15F3O3
InChI InChI=1S/C14H15F3O3/c1-3-5-12(20-13(18)19-4-2)10-6-8-11(9-7-10)14(15,16)17/h3,5-9,12H,4H2,1-2H3
InChIKey IALJWIPKIQTGHU-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/adsc.202201394
Molecular Weight 288.266 g/mol
Quality 87
Reported Formula C14H15F3O3
SMILES C(OC(OCC)=O)(C=CC)C1=CC=C(C=C1)C(F)(F)F
SPLASH splash10-002b-0910000000-dbcdc9ed675756bacafc
Sample Comments E/Z = 89:11
Source of Spectrum ASC-365-SM13-5b (DOI: 10.1002/adsc.202201394)
Wiley ID 1902779