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p-ANISIC ACID, 2-(2,6-DINITRO-alpha,alpha,alpha-TRIFLUORO-p-TOLYL)HYDRAZIDE
SpectraBase Compound ID LLnqeu51ayu
InChI InChI=1S/C15H11F3N4O6/c1-28-10-4-2-8(3-5-10)14(23)20-19-13-11(21(24)25)6-9(15(16,17)18)7-12(13)22(26)27/h2-7,19H,1H3,(H,20,23)
InChIKey ZLHWADACTWASIN-UHFFFAOYSA-N
Mol Weight 400.27 g/mol
Molecular Formula C15H11F3N4O6
Exact Mass 400.063069 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I66Lu3FtNrD
Name p-Anisic acid, 2-(2,6-dinitro-A,A,A-trifluoro-p-tolyl)hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 400.063068573 u
Formula C15H11F3N4O6
InChI InChI=1S/C15H11F3N4O6/c1-28-10-4-2-8(3-5-10)14(23)20-19-13-11(21(24)25)6-9(15(16,17)18)7-12(13)22(26)27/h2-7,19H,1H3,(H,20,23)
InChIKey ZLHWADACTWASIN-UHFFFAOYSA-N
Molecular Weight 400.270 g/mol
SMILES N(C(C=1C=CC(=CC1)OC)=O)NC=1C(=CC(=CC1N(=O)=O)C(F)(F)F)N(=O)=O