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Methyl 6-nitroso-5-oxo-1-phenyl-7-(phenylamino)-1,2,4-triazolo[4,3-a]pyrimidine-3-carboxylate
SpectraBase Compound ID 7xpTQ3AurEI
InChI InChI=1S/C19H14N6O4/c1-29-18(27)16-22-25(13-10-6-3-7-11-13)19-21-15(14(23-28)17(26)24(16)19)20-12-8-4-2-5-9-12/h2-11,20H,1H3
InChIKey ALNPXAHGKUXXME-UHFFFAOYSA-N
Mol Weight 390.36 g/mol
Molecular Formula C19H14N6O4
Exact Mass 390.107653 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9y4iBXjUvBd
Name Methyl 6-nitroso-5-oxo-1-phenyl-7-(phenylamino)-1,2,4-triazolo[4,3-a]pyrimidine-3-carboxylate
Alternate Name(s) Methyl 7-anilino-6-nitroso-5-oxo-1-phenyl-1,5-dihydro[1,2,4]triazolo[4,3-a]pyrimidine-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H14N6O4
InChI InChI=1S/C19H14N6O4/c1-29-18(27)16-22-25(13-10-6-3-7-11-13)19-21-15(14(23-28)17(26)24(16)19)20-12-8-4-2-5-9-12/h2-11,20H,1H3
InChIKey ALNPXAHGKUXXME-UHFFFAOYSA-N
Molecular Weight 390.359 g/mol
SMILES N(C=1N=C2N(C(C1N=O)=O)C(=NN2c1ccccc1)C(=O)OC)c1ccccc1
SPLASH splash10-0006-9313000000-6a42354c4f0f9908d38d
Source of Spectrum H-86-747-23
Wiley ID 1525310