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N-(2-Chloro-2,3,3,3-tetrafluoropropyl)-3,5-dimethoxyaniline
SpectraBase Compound ID K11xaftjrII
InChI InChI=1S/C11H12ClF4NO2/c1-18-8-3-7(4-9(5-8)19-2)17-6-10(12,13)11(14,15)16/h3-5,17H,6H2,1-2H3
InChIKey RYNYZCOYMHJPHJ-UHFFFAOYSA-N
Mol Weight 301.67 g/mol
Molecular Formula C11H12ClF4NO2
Exact Mass 301.049269 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hb9XYVKKZxS
Name N-(2-Chloro-2,3,3,3-tetrafluoropropyl)-3,5-dimethoxyaniline
Appearance Yellow oil
Carrier Gas Helium
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Exact Mass 301.049268980 u
Formula C11H12ClF4NO2
GC Oven Program Oven temp 200 oC
InChI InChI=1S/C11H12ClF4NO2/c1-18-8-3-7(4-9(5-8)19-2)17-6-10(12,13)11(14,15)16/h3-5,17H,6H2,1-2H3
InChIKey RYNYZCOYMHJPHJ-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208420
Molecular Weight 301.669 g/mol
Quality 239
Reported Formula C11H12ClF4NO2
SMILES N(C=1C=C(C=C(C1)OC)OC)CC(F)(Cl)C(F)(F)F
SPLASH splash10-014i-0901000000-8b4a3cc662c634effc12
Source of Spectrum ACI-61-SM50-40 (DOI: 10.1002/anie.202208420)
Thin-Layer Chromatography 0.47 (hexane/ethyl acetate, 4:1)
Wiley ID 1897971