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phenol, 2-[(E)-[[4-(2,2,3,3-tetrafluoropropoxy)phenyl]imino]methyl]-
SpectraBase Compound ID 2L2mYfduFk9
InChI InChI=1S/C16H13F4NO2/c17-15(18)16(19,20)10-23-13-7-5-12(6-8-13)21-9-11-3-1-2-4-14(11)22/h1-9,15,22H,10H2/b21-9+
InChIKey ZFVWPDMDQKTNOG-ZVBGSRNCSA-N
Mol Weight 327.28 g/mol
Molecular Formula C16H13F4NO2
Exact Mass 327.088241 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HOmL2PkV0V7
Name Phenol, 2-[(E)-[[4-(2,2,3,3-tetrafluoropropoxy)phenyl]imino]methyl]-
Comments Computed using HOSE algorithm
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Exact Mass 327.088241313 u
Formula C16H13F4NO2
InChI InChI=1S/C16H13F4NO2/c17-15(18)16(19,20)10-23-13-7-5-12(6-8-13)21-9-11-3-1-2-4-14(11)22/h1-9,15,22H,10H2/b21-9+
InChIKey ZFVWPDMDQKTNOG-ZVBGSRNCSA-N
Molecular Weight 327.279 g/mol
SMILES OC1=C(\C=N\C=2C=CC(OCC(C(F)F)(F)F)=CC2)C=CC=C1