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(1Z)-4-methyl-N-(1,3,5-triphenyl-1,2,4-triazol-1-ium-4-yl)benzenecarboximidate
SpectraBase Compound ID 8bBN0qTrrub
InChI InChI=1S/C28H22N4O/c1-21-17-19-23(20-18-21)27(33)30-32-26(22-11-5-2-6-12-22)29-31(25-15-9-4-10-16-25)28(32)24-13-7-3-8-14-24/h2-20H,1H3
InChIKey FWGNLMHMSXOWHT-UHFFFAOYSA-N
Mol Weight 430.51 g/mol
Molecular Formula C28H22N4O
Exact Mass 430.179361 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JwrUnrh8k9y
Name (1Z)-4-methyl-N-(1,3,5-triphenyl-1,2,4-triazol-1-ium-4-yl)benzenecarboximidate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H22N4O
InChI InChI=1S/C28H22N4O/c1-21-17-19-23(20-18-21)27(33)30-32-26(22-11-5-2-6-12-22)29-31(25-15-9-4-10-16-25)28(32)24-13-7-3-8-14-24/h2-20H,1H3
InChIKey FWGNLMHMSXOWHT-UHFFFAOYSA-N
Molecular Weight 430.511 g/mol
SMILES c1([n+](c(n[n]1-c1ccccc1)-c1ccccc1)[N-]C(c1ccc(cc1)C)=O)-c1ccccc1
SPLASH splash10-0006-9460000000-6785ce9eb4e045e7980a
Source of Spectrum Y-33-594-11
Wiley ID 1381735