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N-[5-(1-benzothiophen-3-yl)pyrazin-2-yl]pyridinium aminide
SpectraBase Compound ID 3fxQzUuKbBG
InChI InChI=1S/C17H12N4S/c1-4-8-21(9-5-1)20-17-11-18-15(10-19-17)14-12-22-16-7-3-2-6-13(14)16/h1-12H
InChIKey SYYIDBKUAGTPNT-UHFFFAOYSA-N
Mol Weight 304.37 g/mol
Molecular Formula C17H12N4S
Exact Mass 304.078268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XJIWUnG3Tv
Name N-[5-(1-benzothiophen-3-yl)pyrazin-2-yl]pyridinium aminide
Appearance Dark orange solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H12N4S
InChI InChI=1S/C17H12N4S/c1-4-8-21(9-5-1)20-17-11-18-15(10-19-17)14-12-22-16-7-3-2-6-13(14)16/h1-12H
InChIKey SYYIDBKUAGTPNT-UHFFFAOYSA-N
Instrument Name Hewlett-Packard 5988A
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.p008.720
Molecular Weight 304.371 g/mol
Reported Formula C17H12N4S
SMILES c1ccc[n+](c1)[N-]c1cnc(cn1)-c1c2c(sc1)cccc2
SPLASH splash10-0ufr-0459000000-fd8abef5a50679fa8c38
Source of Spectrum ARK-2014-327-8d
Wiley ID 1845643