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1,4-Diphenyl-1,2,4,5-tetrazine-3,6-dicarboxylic acid diethyl ester
SpectraBase Compound ID DNt2cXUdL4L
InChI InChI=1S/C20H20N4O4/c1-3-27-19(25)17-21-24(16-13-9-6-10-14-16)18(20(26)28-4-2)22-23(17)15-11-7-5-8-12-15/h5-14H,3-4H2,1-2H3
InChIKey LIDMQSXCEOQXND-UHFFFAOYSA-N
Mol Weight 380.4 g/mol
Molecular Formula C20H20N4O4
Exact Mass 380.148455 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AuWMWqaTAYU
Name 1,4-Diphenyl-1,2,4,5-tetrazine-3,6-dicarboxylic acid diethyl ester
Alternate Name(s) Diethyl 1,4-diphenyl-1,2,4,5-tetrazine-3,6-dicarboxylate [1,2,4,5]Tetrazine-3,6-dicarboxylic acid, 1,4-diphenyl-1,4-dihydro-, diethyl ester
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Formula C20H20N4O4
InChI InChI=1S/C20H20N4O4/c1-3-27-19(25)17-21-24(16-13-9-6-10-14-16)18(20(26)28-4-2)22-23(17)15-11-7-5-8-12-15/h5-14H,3-4H2,1-2H3
InChIKey LIDMQSXCEOQXND-UHFFFAOYSA-N
Molecular Weight 380.404 g/mol
SMILES C1(=NN(c2ccccc2)C(=NN1c1ccccc1)C(=O)OCC)C(=O)OCC
SPLASH splash10-0fur-9515000000-9648db1100ad5e2bf385
Wiley ID 1446041