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N-(2-Chloro-2,3,3,3-tetrafluoropropyl)-[1,1'-biphenyl]-2-amine
SpectraBase Compound ID BnyOdiffuav
InChI InChI=1S/C15H12ClF4N/c16-14(17,15(18,19)20)10-21-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,21H,10H2
InChIKey GAZBQUNTDSGSPN-UHFFFAOYSA-N
Mol Weight 317.71 g/mol
Molecular Formula C15H12ClF4N
Exact Mass 317.05944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIFEsetYCRF
Name N-(2-Chloro-2,3,3,3-tetrafluoropropyl)-[1,1'-biphenyl]-2-amine
Appearance Yellow oil
Carrier Gas Helium
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Exact Mass 317.059439742 u
Formula C15H12ClF4N
GC Oven Program Oven temp 200 oC
InChI InChI=1S/C15H12ClF4N/c16-14(17,15(18,19)20)10-21-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h1-9,21H,10H2
InChIKey GAZBQUNTDSGSPN-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973 GC
Ionization Type EI
Literature Reference DOI 10.1002/anie.202208420
Molecular Weight 317.715 g/mol
Quality 262
Reported Formula C15H12ClF4N
SMILES N(C1=C(C=CC=C1)C1=CC=CC=C1)CC(C(F)(F)F)(Cl)F
SPLASH splash10-001i-0901000000-b2c8246cae12edcdd5a0
Source of Spectrum ACI-61-SM44-19 (DOI: 10.1002/anie.202208420)
Thin-Layer Chromatography 0.78 (hexane/ethyl acetate, 4:1)
Wiley ID 1897947