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2-Propenoic acid, 2-methyl-3-(9-oxo-9H-[1,2,4]triazolo[4',3':2,3]pyr idazino[6,1-c][1,2,4]triazin-8-yl)-, ethyl ester
SpectraBase Compound ID FvDCaqq6iCq
InChI InChI=1S/C13H12N6O3/c1-3-22-13(21)8(2)6-9-12(20)19-11(17-15-9)5-4-10-16-14-7-18(10)19/h4-7H,3H2,1-2H3/b8-6+
InChIKey GSMSTBBRRODKIB-SOFGYWHQSA-N
Mol Weight 300.28 g/mol
Molecular Formula C13H12N6O3
Exact Mass 300.097088 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4TszwiiTxu3
Name 2-Propenoic acid, 2-methyl-3-(9-oxo-9H-[1,2,4]triazolo[4',3':2,3]pyr idazino[6,1-c][1,2,4]triazin-8-yl)-, ethyl ester
CAS Registry Number 107263-08-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12N6O3
InChI InChI=1S/C13H12N6O3/c1-3-22-13(21)8(2)6-9-12(20)19-11(17-15-9)5-4-10-16-14-7-18(10)19/h4-7H,3H2,1-2H3/b8-6+
InChIKey GSMSTBBRRODKIB-SOFGYWHQSA-N
Molecular Weight 300.278 g/mol
SMILES c12[n](N3C(C=C2)=NN=C(C3=O)\C=C\(C(=O)OCC)C)cnn1
SPLASH splash10-0fb9-0096000000-0fc87221754c3f8de56a
Source of Spectrum AH-117-872-8
Synonyms 9H-[1,2,4]Triazolo[4',3':2,3]pyridazino[6,1-c][1,2,4]triazine, 2-propenoic acid deriv. Ethyl (2E)-2-methyl-3-(9-oxo-9H-[1,2,4]triazolo[4',3':2,3]pyridazino[6,1-c][1,2,4]triazin-8-yl)-2-propenoate Ethyl-[3-(6H-6-oxo-1,2,4-triazino[4,3-b](1,2,4-triazolo)[3,4-f]pyridazinyl-7)-2-methylacrylate (E)-2-methyl-3-(9-oxo-[1,2,4]triazolo[2,3]pyridazino[2,6-c][1,2,4]triazin-8-yl)-2-propenoic acid ethyl ester Ethyl (E)-2-methyl-3-(9-oxo-[1,2,4]triazolo[2,3]pyridazino[2,6-c][1,2,4]triazin-8-yl)prop-2-enoate Ethyl (E)-2-methyl-3-(9-oxidanylidene-[1,2,4]triazolo[2,3]pyridazino[2,6-c][1,2,4]triazin-8-yl)prop-2-enoate
Wiley ID 1302441