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3,4,5-Triazatetracyclo[5.5.1.0(2,6).0(8,12)]trideca-3,10-diene, 5-(4-nitrophenyl)-
SpectraBase Compound ID D5LegaUO6JM
InChI InChI=1S/C16H16N4O2/c21-20(22)10-6-4-9(5-7-10)19-16-14-8-13(15(16)17-18-19)11-2-1-3-12(11)14/h1-2,4-7,11-16H,3,8H2
InChIKey MZGICHGTRFQXQA-UHFFFAOYSA-N
Mol Weight 296.33 g/mol
Molecular Formula C16H16N4O2
Exact Mass 296.127326 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2eednKboIUj
Name 3,4,5-Triazatetracyclo[5.5.1.0(2,6).0(8,12)]trideca-3,10-diene, 5-(4-nitrophenyl)-
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16N4O2
InChI InChI=1S/C16H16N4O2/c21-20(22)10-6-4-9(5-7-10)19-16-14-8-13(15(16)17-18-19)11-2-1-3-12(11)14/h1-2,4-7,11-16H,3,8H2
InChIKey MZGICHGTRFQXQA-UHFFFAOYSA-N
Molecular Weight 296.330 g/mol
SMILES C1C2C3C4N(N=NC4C(C2C=C1)C3)c1ccc(N(=O)=O)cc1
SPLASH splash10-0udi-4980000000-32a244e652d5b3bcb7c4
Wiley ID 1466454