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2-[(4-Fluorophenyl)amino]naphthalene-1,4-dione
SpectraBase Compound ID 1va1eqD94dV
InChI InChI=1S/C16H10FNO2/c17-10-5-7-11(8-6-10)18-14-9-15(19)12-3-1-2-4-13(12)16(14)20/h1-9,18H
InChIKey ZOXJEXYGNDMQLG-UHFFFAOYSA-N
Mol Weight 267.26 g/mol
Molecular Formula C16H10FNO2
Exact Mass 267.069557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GZIIRunUsoV
Name 2-[(4-Fluorophenyl)amino]naphthalene-1,4-dione
Comments Computed using HOSE algorithm
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Exact Mass 267.069556727 u
Formula C16H10FNO2
InChI InChI=1S/C16H10FNO2/c17-10-5-7-11(8-6-10)18-14-9-15(19)12-3-1-2-4-13(12)16(14)20/h1-9,18H
InChIKey ZOXJEXYGNDMQLG-UHFFFAOYSA-N
Molecular Weight 267.259 g/mol
SMILES C12=C(C=CC=C2)C(C=C(C1=O)NC=1C=CC(=CC1)F)=O