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2-Chlorobicyclo[2.2.2]oct-5-ene-2-carbonitrile
SpectraBase Compound ID KwWmrZs9bRB
InChI InChI=1S/C9H10ClN/c10-9(6-11)5-7-1-3-8(9)4-2-7/h1,3,7-8H,2,4-5H2/t7-,8+,9+/m0/s1
InChIKey UXJUGRIRUINQDY-DJLDLDEBSA-N
Mol Weight 167.64 g/mol
Molecular Formula C9H10ClN
Exact Mass 167.050177 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EEbMvMz3ARb
Name 2-Chlorobicyclo[2.2.2]oct-5-ene-2-carbonitrile
Alternate Name(s) 5-Chloranylbicyclo[2.2.2]oct-2-ene-5-carbonitrile 5-Chloro-5-bicyclo[2.2.2]oct-2-enecarbonitrile 5-Chlorobicyclo[2.2.2]oct-2-ene-5-carbonitrile Bicyclo[2.2.2]oct-5-ene-2-carbonitrile, 2-chloro-
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Formula C9H10ClN
InChI InChI=1S/C9H10ClN/c10-9(6-11)5-7-1-3-8(9)4-2-7/h1,3,7-8H,2,4-5H2/t7-,8+,9+/m0/s1
InChIKey UXJUGRIRUINQDY-DJLDLDEBSA-N
Molecular Weight 167.639 g/mol
SMILES C1C[C@@]2([C@@](C[C@]1(C=C2)[H])(C#N)Cl)[H]
SPLASH splash10-001i-9100000000-83817e6d4715c31626e7
Wiley ID 1490176