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N-(2-Chloro-2,3,3,3-tetrafluoropropyl)aniline
SpectraBase Compound ID L4kzyxP6frY
InChI InChI=1S/C9H8ClF4N/c10-8(11,9(12,13)14)6-15-7-4-2-1-3-5-7/h1-5,15H,6H2
InChIKey NCTRQHGVNJEIDJ-UHFFFAOYSA-N
Mol Weight 241.62 g/mol
Molecular Formula C9H8ClF4N
Exact Mass 241.02814 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hu2Rlkp3yMz
Name N-(2-Chloro-2,3,3,3-tetrafluoropropyl)aniline
Appearance Yellow oil
Carrier Gas Helium
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Exact Mass 241.028139614 u
Formula C9H8ClF4N
GC Oven Program Oven temp 200 oC
InChI InChI=1S/C9H8ClF4N/c10-8(11,9(12,13)14)6-15-7-4-2-1-3-5-7/h1-5,15H,6H2
InChIKey NCTRQHGVNJEIDJ-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208420
Molecular Weight 241.617 g/mol
Quality 289
Reported Formula C9H8ClF4N
SMILES N(C1=CC=CC=C1)CC(C(F)(F)F)(Cl)F
SPLASH splash10-0a4i-3910000000-d7c71c692abecf46a938
Source of Spectrum ACI-61-SM42-15 (DOI: 10.1002/anie.202208420)
Thin-Layer Chromatography 0.50 (hexane/ethyl acetate, 4:1)
Wiley ID 1897943