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Methanimidic acid, N-[3-methyl-4-oxo-7-(phenylamino)[1,2,4]triazolo[5,1-c][1,2,4]triazin-8(4H)-yl]-, ethyl ester
SpectraBase Compound ID 1OOTrnbzmRb
InChI InChI=1S/C14H15N7O2/c1-3-23-9-15-21-13(16-11-7-5-4-6-8-11)19-20-12(22)10(2)17-18-14(20)21/h4-9H,3H2,1-2H3,(H,16,19)/b15-9+
InChIKey CCULPVXNKKAJHJ-OQLLNIDSSA-N
Mol Weight 313.32 g/mol
Molecular Formula C14H15N7O2
Exact Mass 313.128723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H6yBlXOjqt5
Name Methanimidic acid, N-[3-methyl-4-oxo-7-(phenylamino)[1,2,4]triazolo[5,1-c][1,2,4]triazin-8(4H)-yl]-, ethyl ester
CAS Registry Number 109072-11-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N7O2
InChI InChI=1S/C14H15N7O2/c1-3-23-9-15-21-13(16-11-7-5-4-6-8-11)19-20-12(22)10(2)17-18-14(20)21/h4-9H,3H2,1-2H3,(H,16,19)/b15-9+
InChIKey CCULPVXNKKAJHJ-OQLLNIDSSA-N
Molecular Weight 313.321 g/mol
SMILES N(C1=NN2C(N1\N=C\OCC)=NN=C(C2=O)C)c1ccccc1
SPLASH splash10-03dl-0198000000-2e11dd5682601aadbe07
Source of Spectrum KC-1986-2048-57
Synonyms [1,2,4]Triazolo[5,1-c][1,2,4]triazine, methanimidic acid deriv. 8-Ethoxymetheleneamino-7-anilino-3-methyl[1,2,4]triazolo[5,1-c][1,2,4]triazin-4(8H)-one Ethyl 7-anilino-3-methyl-4-oxo[1,2,4]triazolo[5,1-c][1,2,4]triazin-8(4H)-ylimidoformate
Wiley ID 1314080