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1-(chloroacetyl)-2-{2-[5-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2H-tetrazol-2-yl]propionyl}hydrazine
SpectraBase Compound ID Ld60mkn1ZZY
InChI InChI=1S/C14H11ClF6N6O2/c1-6(12(29)24-22-10(28)5-15)27-25-11(23-26-27)7-2-8(13(16,17)18)4-9(3-7)14(19,20)21/h2-4,6H,5H2,1H3,(H,22,28)(H,24,29)
InChIKey WQRYIHPVMZIUMQ-UHFFFAOYSA-N
Mol Weight 444.73 g/mol
Molecular Formula C14H11ClF6N6O2
Exact Mass 444.05362 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8PHo0KtMkTq
Name 1-(chloroacetyl)-2-{2-[5-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2H-tetrazol-2-yl]propionyl}hydrazine
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Formula C14H11ClF6N6O2
InChI InChI=1S/C14H11ClF6N6O2/c1-6(12(29)24-22-10(28)5-15)27-25-11(23-26-27)7-2-8(13(16,17)18)4-9(3-7)14(19,20)21/h2-4,6H,5H2,1H3,(H,22,28)(H,24,29)
InChIKey WQRYIHPVMZIUMQ-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 56634M
Solvent Polysol