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3,6-Bis(4-nitrobenzyl)-1,2,4,5-tetraazine
SpectraBase Compound ID IwcsyEI8qYg
InChI InChI=1S/C16H12N6O4/c23-21(24)13-5-1-11(2-6-13)9-15-17-19-16(20-18-15)10-12-3-7-14(8-4-12)22(25)26/h1-8H,9-10H2
InChIKey BJEWJOQCZGVNAI-UHFFFAOYSA-N
Mol Weight 352.31 g/mol
Molecular Formula C16H12N6O4
Exact Mass 352.092003 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L0TFxnAix10
Name 3,6-Bis(4-nitrobenzyl)-1,2,4,5-tetraazine
CAS Registry Number 82481-30-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N6O4
InChI InChI=1S/C16H12N6O4/c23-21(24)13-5-1-11(2-6-13)9-15-17-19-16(20-18-15)10-12-3-7-14(8-4-12)22(25)26/h1-8H,9-10H2
InChIKey BJEWJOQCZGVNAI-UHFFFAOYSA-N
Molecular Weight 352.310 g/mol
SMILES c1cc(ccc1Cc1nnc(Cc2ccc(cc2)N(=O)=O)nn1)N(=O)=O
SPLASH splash10-014i-4900000000-b40eba72647e9d735014
Source of Spectrum W5-1989-9708-1
Synonyms 1,2,4,5-Tetrazine, 3,6-bis(4-nitrophenyl)methyl]- 3,6-bis(4-nitrobenzyl)-1,2,4,5-tetrazine 3,6-bis[(4-nitrophenyl)methyl]-1,2,4,5-tetrazine
Wiley ID 1342996