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1-{N-Benzyl-N-[5-phenyl-3-(thiophen-3-yl)pyridin-2-yl]amino}pyridium bromide
SpectraBase Compound ID od6Rm14Sbl
InChI InChI=1S/C27H22N3S.BrH/c1-4-10-22(11-5-1)20-30(29-15-8-3-9-16-29)27-26(24-14-17-31-21-24)18-25(19-28-27)23-12-6-2-7-13-23;/h1-19,21H,20H2;1H/q+1;/p-1
InChIKey RHJOGZMNFVEHLP-UHFFFAOYSA-M
Mol Weight 500.46 g/mol
Molecular Formula C27H22BrN3S
Exact Mass 499.071782 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DePOq1nc8KJ
Name 1-{N-Benzyl-N-[5-phenyl-3-(thiophen-3-yl)pyridin-2-yl]amino}pyridium bromide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22BrN3S
InChI InChI=1S/C27H22N3S.BrH/c1-4-10-22(11-5-1)20-30(29-15-8-3-9-16-29)27-26(24-14-17-31-21-24)18-25(19-28-27)23-12-6-2-7-13-23;/h1-19,21H,20H2;1H/q+1;/p-1
InChIKey RHJOGZMNFVEHLP-UHFFFAOYSA-M
Molecular Weight 500.458 g/mol
SMILES [Br-].c1(N([n+]2ccccc2)Cc2ccccc2)c(cc(cn1)-c1ccccc1)-c1cscc1
SPLASH splash10-000i-1149000000-1c7d06459e6eb1ceb77d
Source of Spectrum F-66-2630-13a
Wiley ID 1682438