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1-{[6-(4-Chlorophenyl)pyridin-3-yl]methyl}-1H-benzotriazole
SpectraBase Compound ID H5fHMNtlyEm
InChI InChI=1S/C18H13ClN4/c19-15-8-6-14(7-9-15)16-10-5-13(11-20-16)12-23-18-4-2-1-3-17(18)21-22-23/h1-11H,12H2
InChIKey LVEIULPPQZLUAR-UHFFFAOYSA-N
Mol Weight 320.78 g/mol
Molecular Formula C18H13ClN4
Exact Mass 320.082874 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hn3l3GWgrk6
Name 1-{[6-(4-Chlorophenyl)pyridin-3-yl]methyl}-1H-benzotriazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClN4
InChI InChI=1S/C18H13ClN4/c19-15-8-6-14(7-9-15)16-10-5-13(11-20-16)12-23-18-4-2-1-3-17(18)21-22-23/h1-11H,12H2
InChIKey LVEIULPPQZLUAR-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95 XP
Ionization Type EI positive ion
Literature Reference DOI 10.1021/acs.jmedchem.8b00161
Molecular Weight 320.783 g/mol
SMILES c1ccc2nn[n](Cc3cnc(-c4ccc(cc4)Cl)cc3)c2c1
SPLASH splash10-0006-4392000000-615eec8c300caff7d4b1
Source of Spectrum AF-62-242-18
Wiley ID 1871928