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3-(4-phenyl-1H-1,2,3-triazol-1-yl)quinoxalin-2-amine
SpectraBase Compound ID KlHI7Ksoasl
InChI InChI=1S/C16H12N6/c17-15-16(19-13-9-5-4-8-12(13)18-15)22-10-14(20-21-22)11-6-2-1-3-7-11/h1-10H,(H2,17,18)
InChIKey XAKPOUMBAWIAJL-UHFFFAOYSA-N
Mol Weight 288.31 g/mol
Molecular Formula C16H12N6
Exact Mass 288.112344 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1lUYWvcwgC
Name 3-(4-phenyl-1H-1,2,3-triazol-1-yl)quinoxalin-2-amine
Appearance Yellow solid
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Exact Mass 288.112344410 u
Formula C16H12N6
InChI InChI=1S/C16H12N6/c17-15-16(19-13-9-5-4-8-12(13)18-15)22-10-14(20-21-22)11-6-2-1-3-7-11/h1-10H,(H2,17,18)
InChIKey XAKPOUMBAWIAJL-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.18.111
Molecular Weight 288.314 g/mol
Quality 156
Reported Formula C16H12N6
SMILES NC=1C(N2N=NC(C3=CC=CC=C3)=C2)=NC2=C(N1)C=CC=C2
SPLASH splash10-01ox-2890000000-41fad1a89b648645b8ce
Source of Spectrum BJO-18-SM74-S6a (DOI: 10.3762/bjoc.18.111)
Thin-Layer Chromatography 0.41 (cyclohexane/ethyl acetate, 2:1)
Wiley ID 1901228