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6-(4-methoxyphenyl)-3-[6-[6-(4-methoxyphenyl)-4-oxidanidyl-1,2,4-triazin-4-ium-3-yl]pyridin-2-yl]-4-oxidanidyl-1,2,4-triazin-4-ium

View entire compound with spectra: 1 MS (GC)

6-(4-methoxyphenyl)-3-[6-[6-(4-methoxyphenyl)-4-oxidanidyl-1,2,4-triazin-4-ium-3-yl]pyridin-2-yl]-4-oxidanidyl-1,2,4-triazin-4-ium
SpectraBase Compound ID HWVwiOOoifq
InChI InChI=1S/C25H19N7O4/c1-35-18-10-6-16(7-11-18)22-14-31(33)24(29-27-22)20-4-3-5-21(26-20)25-30-28-23(15-32(25)34)17-8-12-19(36-2)13-9-17/h3-15H,1-2H3
InChIKey UHXIIUWJOSBTPU-UHFFFAOYSA-N
Mol Weight 481.47 g/mol
Molecular Formula C25H19N7O4
Exact Mass 481.149852 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8a3cGN74ZT1
Name 6-(4-methoxyphenyl)-3-[6-[6-(4-methoxyphenyl)-4-oxidanidyl-1,2,4-triazin-4-ium-3-yl]pyridin-2-yl]-4-oxidanidyl-1,2,4-triazin-4-ium
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19N7O4
InChI InChI=1S/C25H19N7O4/c1-35-18-10-6-16(7-11-18)22-14-31(33)24(29-27-22)20-4-3-5-21(26-20)25-30-28-23(15-32(25)34)17-8-12-19(36-2)13-9-17/h3-15H,1-2H3
InChIKey UHXIIUWJOSBTPU-UHFFFAOYSA-N
Molecular Weight 481.472 g/mol
SMILES c1([n+](cc(nn1)-c1ccc(cc1)OC)[O-])-c1nc(-c2[n+](cc(nn2)-c2ccc(cc2)OC)[O-])ccc1
SPLASH splash10-001i-0900000000-a99b342c988f9b9b7575
Source of Spectrum F-68-2886-8
Synonyms 6-(4-methoxyphenyl)-3-[6-[6-(4-methoxyphenyl)-4-oxido-1,2,4-triazin-4-ium-3-yl]-2-pyridinyl]-4-oxido-1,2,4-triazin-4-ium 6-(4-methoxyphenyl)-3-[6-[6-(4-methoxyphenyl)-4-oxido-1,2,4-triazin-4-ium-3-yl]-2-pyridyl]-4-oxido-1,2,4-triazin-4-ium 6-(4-methoxyphenyl)-3-[6-[6-(4-methoxyphenyl)-4-oxido-1,2,4-triazin-4-ium-3-yl]pyridin-2-yl]-4-oxido-1,2,4-triazin-4-ium
Wiley ID 1572212