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2,6-Bis[5-cyano-6-(4-bromophenyl)-1,2,4-triazin-3-yl]pyridine

View entire compound with spectra: 2 MS (GC)

2,6-Bis[5-cyano-6-(4-bromophenyl)-1,2,4-triazin-3-yl]pyridine
SpectraBase Compound ID eBxXRSzN37
InChI InChI=1S/C25H11Br2N9/c26-16-8-4-14(5-9-16)22-20(12-28)31-24(35-33-22)18-2-1-3-19(30-18)25-32-21(13-29)23(34-36-25)15-6-10-17(27)11-7-15/h1-11H
InChIKey PMPIQOARBXODIX-UHFFFAOYSA-N
Mol Weight 597.23 g/mol
Molecular Formula C25H11Br2N9
Exact Mass 594.950417 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CFo9UwA322P
Name 2,6-Bis[5-cyano-6-(4-bromophenyl)-1,2,4-triazin-3-yl]pyridine
Alternate Name(s) 6-(4-bromophenyl)-3-{6-[6-(4-bromophenyl)-5-cyano-1,2,4-triazin-3-yl]-2-pyridinyl}-1,2,4-triazine-5-carbonitrile
Comments Less than 3 mono-isotopic peaks
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Formula C25H11Br2N9
InChI InChI=1S/C25H11Br2N9/c26-16-8-4-14(5-9-16)22-20(12-28)31-24(35-33-22)18-2-1-3-19(30-18)25-32-21(13-29)23(34-36-25)15-6-10-17(27)11-7-15/h1-11H
InChIKey PMPIQOARBXODIX-UHFFFAOYSA-N
Molecular Weight 597.234 g/mol
SMILES c1(cccc(n1)-c1nnc(c(n1)C#N)-c1ccc(cc1)Br)-c1nnc(c(n1)C#N)-c1ccc(cc1)Br
SPLASH splash10-0006-0000090000-46b94856072442c1f0bd
Source of Spectrum C5-2003-2403-3
Wiley ID 1616145