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Dimethyl 2-(1-(perfluoropyridin-4-yl)propan-2-yl)succinate
SpectraBase Compound ID D27nV8DxIuq
InChI InChI=1S/C14H15F4NO4/c1-6(7(14(21)23-3)5-9(20)22-2)4-8-10(15)12(17)19-13(18)11(8)16/h6-7H,4-5H2,1-3H3
InChIKey TWOKMKGUZACMCG-UHFFFAOYSA-N
Mol Weight 337.27 g/mol
Molecular Formula C14H15F4NO4
Exact Mass 337.093721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8nlmvD0UPTk
Name Dimethyl 2-(1-(perfluoropyridin-4-yl)propan-2-yl)succinate
Appearance Colorless oil
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Formula C14H15F4NO4
InChI InChI=1S/C14H15F4NO4/c1-6(7(14(21)23-3)5-9(20)22-2)4-8-10(15)12(17)19-13(18)11(8)16/h6-7H,4-5H2,1-3H3
InChIKey TWOKMKGUZACMCG-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201901135
Molecular Weight 337.271 g/mol
Reported Formula C14H15F4NO4
SMILES C(OC)(C(C(Cc1c(c(nc(c1F)F)F)F)C)CC(OC)=O)=O
SPLASH splash10-08fs-3900000000-967895b61dd821761be0
Sample Comments dr = 1:1
Source of Spectrum U1-2020-SM14-3l-.beta.
Wiley ID 1858830