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(1-Bicyclo[4.2.1]octylmethylidene)-2,4,6-trinitroaniline
SpectraBase Compound ID Gqscj1Am6xh
InChI InChI=1S/C16H18N4O6/c21-18(22)12-7-13(19(23)24)15(14(8-12)20(25)26)17-10-16-5-2-1-3-11(9-16)4-6-16/h7-8,10-11H,1-6,9H2/b17-10+/t11-,16+/m1/s1
InChIKey ARWLJROIXFGVDO-RIWWXLNISA-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 LkVByZMwQSY
Name (1-Bicyclo[4.2.1]octylmethylidene)-2,4,6-trinitroaniline
Alternate Name(s) N-[(E)-bicyclo[4.2.1]non-1-ylmethylidene]-2,4,6-trinitroaniline N-[(E)-bicyclo[4.2.1]non-1-ylmethylidene]-N-(2,4,6-trinitrophenyl)amine
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Formula C16H18N4O6
InChI InChI=1S/C16H18N4O6/c21-18(22)12-7-13(19(23)24)15(14(8-12)20(25)26)17-10-16-5-2-1-3-11(9-16)4-6-16/h7-8,10-11H,1-6,9H2/b17-10+/t11-,16+/m1/s1
InChIKey ARWLJROIXFGVDO-RIWWXLNISA-N
Molecular Weight 362.342 g/mol
SMILES c1(c(c(N(=O)=O)cc(N(=O)=O)c1)\N=C\[C@]12C[C@](CCCC2)(CC1)[H])N(=O)=O
SPLASH splash10-05o0-9200000000-006de1b6cd6c549f2c8d
Source of Spectrum C-114-4855-37
Wiley ID 1349351