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(2E)-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(hydroxyimino)ethanamide
SpectraBase Compound ID IqdkIitcuSm
InChI InChI=1S/C9H6ClF3N2O2/c10-6-2-1-5(9(11,12)13)3-7(6)15-8(16)4-14-17/h1-4,17H,(H,15,16)/b14-4+
InChIKey QKQNIHJNRZHPFN-LNKIKWGQSA-N
Mol Weight 266.61 g/mol
Molecular Formula C9H6ClF3N2O2
Exact Mass 266.00699 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BmU8ElN3bTf
Name (2E)-N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-(hydroxyimino)ethanamide
Comments Computed using HOSE algorithm
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Exact Mass 266.006989628 u
Formula C9H6ClF3N2O2
InChI InChI=1S/C9H6ClF3N2O2/c10-6-2-1-5(9(11,12)13)3-7(6)15-8(16)4-14-17/h1-4,17H,(H,15,16)/b14-4+
InChIKey QKQNIHJNRZHPFN-LNKIKWGQSA-N
Molecular Weight 266.607 g/mol
SMILES N(C1=CC(C(F)(F)F)=CC=C1Cl)C(\C=N\O)=O