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2-Amino-5-chloro-2'-fluorobenzophenone, N-heptafluorobutyryl-

View entire compound with spectra: 1 NMR

2-Amino-5-chloro-2'-fluorobenzophenone, N-heptafluorobutyryl-
SpectraBase Compound ID LCkBn6b2P5p
InChI InChI=1S/C17H8ClF8NO2/c18-8-5-6-12(10(7-8)13(28)9-3-1-2-4-11(9)19)27-14(29)15(20,21)16(22,23)17(24,25)26/h1-7H,(H,27,29)
InChIKey YSAJAIVWVWNFPZ-UHFFFAOYSA-N
Mol Weight 445.7 g/mol
Molecular Formula C17H8ClF8NO2
Exact Mass 445.011582 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DngNgl2YUNL
Name 2-Amino-5-chloro-2'-fluorobenzophenone, N-heptafluorobutyryl-
Comments Computed using HOSE algorithm
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Exact Mass 445.011581504 u
Formula C17H8ClF8NO2
InChI InChI=1S/C17H8ClF8NO2/c18-8-5-6-12(10(7-8)13(28)9-3-1-2-4-11(9)19)27-14(29)15(20,21)16(22,23)17(24,25)26/h1-7H,(H,27,29)
InChIKey YSAJAIVWVWNFPZ-UHFFFAOYSA-N
Molecular Weight 445.696 g/mol
SMILES C1(F)=C(C=CC=C1)C(=O)C1=C(C=CC(=C1)Cl)NC(=O)C(C(C(F)(F)F)(F)F)(F)F