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7'-Bicyclo[4.2.2]decylidene-2,4,6-trinitroaniline
SpectraBase Compound ID LCU3TULOjhM
InChI InChI=1S/C16H18N4O6/c21-18(22)12-8-14(19(23)24)16(15(9-12)20(25)26)17-13-7-10-3-1-2-4-11(13)6-5-10/h8-11H,1-7H2/b17-13+/t10-,11-/m1/s1
InChIKey NTKDSXRQTATJAR-SJZWRUIUSA-N
Mol Weight 362.34 g/mol
Molecular Formula C16H18N4O6
Exact Mass 362.122634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G9HcGIOiDwL
Name 7'-Bicyclo[4.2.2]decylidene-2,4,6-trinitroaniline
Alternate Name(s) N-[(7E)-bicyclo[4.2.2]dec-7-ylidene]-2,4,6-trinitroaniline N-[(7E)-bicyclo[4.2.2]dec-7-ylidene]-N-(2,4,6-trinitrophenyl)amine
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Formula C16H18N4O6
InChI InChI=1S/C16H18N4O6/c21-18(22)12-8-14(19(23)24)16(15(9-12)20(25)26)17-13-7-10-3-1-2-4-11(13)6-5-10/h8-11H,1-7H2/b17-13+/t10-,11-/m1/s1
InChIKey NTKDSXRQTATJAR-SJZWRUIUSA-N
Molecular Weight 362.342 g/mol
SMILES c1(c(N(=O)=O)cc(N(=O)=O)cc1N(=O)=O)\N=C/1C[C@@]2(CCCC[C@@]1(CC2)[H])[H]
SPLASH splash10-003r-9100000000-89e613047b324e738d14
Source of Spectrum C-114-4855-35
Wiley ID 1349350