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3-Amino-6-[9-phenanthryl]-1,2,4-triazine
SpectraBase Compound ID F88Hi1FjtNu
InChI InChI=1S/C17H12N4/c18-17-19-10-16(20-21-17)15-9-11-5-1-2-6-12(11)13-7-3-4-8-14(13)15/h1-10H,(H2,18,19,21)
InChIKey VHTYRGQAJATTLL-UHFFFAOYSA-N
Mol Weight 272.31 g/mol
Molecular Formula C17H12N4
Exact Mass 272.106196 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ed7Y05KcqdZ
Name 3-Amino-6-[9-phenanthryl]-1,2,4-triazine
Comments Computed using HOSE algorithm
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Exact Mass 272.106196402 u
Formula C17H12N4
InChI InChI=1S/C17H12N4/c18-17-19-10-16(20-21-17)15-9-11-5-1-2-6-12(11)13-7-3-4-8-14(13)15/h1-10H,(H2,18,19,21)
InChIKey VHTYRGQAJATTLL-UHFFFAOYSA-N
SMILES C1(N)=NN=C(C=N1)C1=CC2=C(C=CC=C2)C2=CC=CC=C12