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5,6-Diphenyl-3-(5-hexynyl)-1,2,4-triazine
SpectraBase Compound ID Lu2oMSX2a2X
InChI InChI=1S/C21H19N3/c1-2-3-4-11-16-19-22-20(17-12-7-5-8-13-17)21(24-23-19)18-14-9-6-10-15-18/h1,5-10,12-15H,3-4,11,16H2
InChIKey DNMBWYJFUKSHGR-UHFFFAOYSA-N
Mol Weight 313.4 g/mol
Molecular Formula C21H19N3
Exact Mass 313.157898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2DFk9GZWRIm
Name 5,6-Diphenyl-3-(5-hexynyl)-1,2,4-triazine
CAS Registry Number 130905-56-5
Comments Less than 3 mono-isotopic peaks
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Formula C21H19N3
InChI InChI=1S/C21H19N3/c1-2-3-4-11-16-19-22-20(17-12-7-5-8-13-17)21(24-23-19)18-14-9-6-10-15-18/h1,5-10,12-15H,3-4,11,16H2
InChIKey DNMBWYJFUKSHGR-UHFFFAOYSA-N
Molecular Weight 313.404 g/mol
SMILES c1(nnc(nc1-c1ccccc1)CCCCC#C)-c1ccccc1
SPLASH splash10-004i-0901000000-fac6ef32238b84a10865
Source of Spectrum J-56-1812-9
Synonyms 3-(5-hexynyl)-5,6-diphenyl-1,2,4-triazine
Wiley ID 1314464