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1-Ethoxalyl-2,4,6-triphenyl-1,2,3,4-tetrahydro-sym-tetrazine
SpectraBase Compound ID K1zFx82DRGO
InChI InChI=1S/C24H22N4O3/c1-2-31-24(30)23(29)27-22(19-12-6-3-7-13-19)18-26(20-14-8-4-9-15-20)25-28(27)21-16-10-5-11-17-21/h3-18,25H,2H2,1H3
InChIKey HKSBAQPUVOBJST-UHFFFAOYSA-N
Mol Weight 414.47 g/mol
Molecular Formula C24H22N4O3
Exact Mass 414.169191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YR9cyEbvJH
Name 1-Ethoxalyl-2,4,6-triphenyl-1,2,3,4-tetrahydro-sym-tetrazine
Alternate Name(s) 1-Ethoxalyl-2,4,6-triphenyl-1,2,3,4-tetraydro-sym-tetrazine Ethyl oxo(2,4,6-triphenyl-3,4-dihydro-1,2,3,4-tetraazin-1(2H)-yl)acetate
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Formula C24H22N4O3
InChI InChI=1S/C24H22N4O3/c1-2-31-24(30)23(29)27-22(19-12-6-3-7-13-19)18-26(20-14-8-4-9-15-20)25-28(27)21-16-10-5-11-17-21/h3-18,25H,2H2,1H3
InChIKey HKSBAQPUVOBJST-UHFFFAOYSA-N
Molecular Weight 414.465 g/mol
SMILES N1N(C=C(N(N1c1ccccc1)C(C(=O)OCC)=O)c1ccccc1)c1ccccc1
SPLASH splash10-0nos-9202100000-c48b0a2d3ddd41b747f1
Source of Spectrum HC-23-1227-0
Wiley ID 1375461