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3-(4-Chlorophenyl)-1,7-dimethyl-1,2,3,4-tetrahydro-6H-[1,2,4]triazino[4,3-b][1,2,4,5]tetraazin-6-one
SpectraBase Compound ID 9GMgl1x86p0
InChI InChI=1S/C12H13ClN6O/c1-7-11(20)19-12(15-14-7)18(2)16-10(17-19)8-3-5-9(13)6-4-8/h3-6,10,16-17H,1-2H3
InChIKey GEWXZAVXQKWDHE-UHFFFAOYSA-N
Mol Weight 292.73 g/mol
Molecular Formula C12H13ClN6O
Exact Mass 292.083937 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzMyZJYsHCC
Name 3-(4-Chlorophenyl)-1,7-dimethyl-1,2,3,4-tetrahydro-6H-[1,2,4]triazino[4,3-b][1,2,4,5]tetraazin-6-one
CAS Registry Number 116471-29-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClN6O
InChI InChI=1S/C12H13ClN6O/c1-7-11(20)19-12(15-14-7)18(2)16-10(17-19)8-3-5-9(13)6-4-8/h3-6,10,16-17H,1-2H3
InChIKey GEWXZAVXQKWDHE-UHFFFAOYSA-N
Molecular Weight 292.730 g/mol
SMILES N1N(C2=NN=C(C(N2NC1c1ccc(cc1)Cl)=O)C)C
SPLASH splash10-01qi-3910000000-1ecf111b625b633e88e3
Source of Spectrum F-44-2256-6
Synonyms 3-(4-Chlorophenyl)-1,2,3,4-tetrahydro-1,7-dimethyl(6H)-[1,2,4]triazino[4,3-b][1,2,4,5]tetrazin-6-one 3-(4-Chlorophenyl)-1,7-dimethyl-3,4-dihydro-2H-[1,2,4]triazino[4,3-b][1,2,4,5]tetrazin-6-one
Wiley ID 1294981