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4-((2-Chloro-2,3,3,3-tetrafluoropropyl)amino)benzonitrile
SpectraBase Compound ID BgzqSX0PHoo
InChI InChI=1S/C10H7ClF4N2/c11-9(12,10(13,14)15)6-17-8-3-1-7(5-16)2-4-8/h1-4,17H,6H2
InChIKey AEXQKYPTPMUBHQ-UHFFFAOYSA-N
Mol Weight 266.63 g/mol
Molecular Formula C10H7ClF4N2
Exact Mass 266.023389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8uYMnPVsBJy
Name 4-((2-Chloro-2,3,3,3-tetrafluoropropyl)amino)benzonitrile
Appearance Yellow solid
Carrier Gas Helium
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Exact Mass 266.023388585 u
Formula C10H7ClF4N2
GC Oven Program Oven temp 200 oC
InChI InChI=1S/C10H7ClF4N2/c11-9(12,10(13,14)15)6-17-8-3-1-7(5-16)2-4-8/h1-4,17H,6H2
InChIKey AEXQKYPTPMUBHQ-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208420
Molecular Weight 266.627 g/mol
Quality 282
Reported Formula C10H7ClF4N2
SMILES N(C=1C=CC(=CC1)C#N)CC(F)(Cl)C(F)(F)F
SPLASH splash10-001i-1910000000-3755ae5a7a29123980af
Source of Spectrum ACI-61-SM42-34 (DOI: 10.1002/anie.202208420)
Wiley ID 1897962