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N-Benzyl-N-[3-bromo-5-(4-methylphenyl)pyrazin-2-yl]amine
SpectraBase Compound ID 9EmueS7qmWH
InChI InChI=1S/C18H16BrN3/c1-13-7-9-15(10-8-13)16-12-21-18(17(19)22-16)20-11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,20,21)
InChIKey XWVGARXJSDMLDC-UHFFFAOYSA-N
Mol Weight 354.25 g/mol
Molecular Formula C18H16BrN3
Exact Mass 353.052761 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5HSkycJhAW
Name N-Benzyl-N-[3-bromo-5-(4-methylphenyl)pyrazin-2-yl]amine
Appearance Yellow oil
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Formula C18H16BrN3
InChI InChI=1S/C18H16BrN3/c1-13-7-9-15(10-8-13)16-12-21-18(17(19)22-16)20-11-14-5-3-2-4-6-14/h2-10,12H,11H2,1H3,(H,20,21)
InChIKey XWVGARXJSDMLDC-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 5988A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.720
Molecular Weight 354.251 g/mol
Reported Formula C18H16(79)BrN3
SMILES N(c1c(nc(cn1)-c1ccc(cc1)C)Br)Cc1ccccc1
SPLASH splash10-03yi-0690000000-88a6759da96cd3df1d28
Source of Spectrum ARK-2014-331-10b
Wiley ID 1845620