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4-(alpha,alpha,alpha,alpha',alpha',alpha'-HEXAFLUORO-3,5-XYLYL)-1-OXO-2(1H)-PHTHALAZINEPROPIONITRILE
SpectraBase Compound ID 7zThri8eAMb
InChI InChI=1S/C19H11F6N3O/c20-18(21,22)12-8-11(9-13(10-12)19(23,24)25)16-14-4-1-2-5-15(14)17(29)28(27-16)7-3-6-26/h1-2,4-5,8-10H,3,7H2
InChIKey OAEPVQCGALNBCW-UHFFFAOYSA-N
Mol Weight 411.31 g/mol
Molecular Formula C19H11F6N3O
Exact Mass 411.080631 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1TaFoMjdiRQ
Name 4-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-1-oxo-2(1H)phthalazinepropionitrile
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Formula C19H11F6N3O
InChI InChI=1S/C19H11F6N3O/c20-18(21,22)12-8-11(9-13(10-12)19(23,24)25)16-14-4-1-2-5-15(14)17(29)28(27-16)7-3-6-26/h1-2,4-5,8-10H,3,7H2
InChIKey OAEPVQCGALNBCW-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 46267M
Solvent CDCl3