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3-Methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one

View entire compound with spectra: 1 MS (GC)

3-Methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one
SpectraBase Compound ID 7E07dsgqTVD
InChI InChI=1S/C18H14N6O3/c1-12-20-22(14-7-9-15(10-8-14)24(26)27)18-19-16(11-17(25)23(18)21-12)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,21)
InChIKey LYWDMYXMSAOLLN-UHFFFAOYSA-N
Mol Weight 362.35 g/mol
Molecular Formula C18H14N6O3
Exact Mass 362.112738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID jN1sL3AT1s
Name 3-Methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H14N6O3
InChI InChI=1S/C18H14N6O3/c1-12-20-22(14-7-9-15(10-8-14)24(26)27)18-19-16(11-17(25)23(18)21-12)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,21)
InChIKey LYWDMYXMSAOLLN-UHFFFAOYSA-N
Molecular Weight 362.349 g/mol
SMILES N1C(=NN2C(N1c1ccc(N(=O)=O)cc1)=NC(=CC2=O)c1ccccc1)C
SPLASH splash10-03di-1419000000-b51b4b3db50a21e7d1cf
Source of Spectrum Y-39-49-6
Wiley ID 1528324