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5-Cyanobicyclo[2.2.2]oct-3-oxo-7-ene-2-spiro-(2'-4'-methylene-oxolane)
SpectraBase Compound ID 1ciQtr7cLZl
InChI InChI=1S/C13H13NO2/c14-5-7-3-8-1-2-10(7)12(15)13(8)9-4-11(13)16-6-9/h1-2,7-11H,3-4,6H2/t7-,8-,9+,10+,11+,13+/m0/s1
InChIKey IPZBBWKANDUMLC-DQBXORCPSA-N
Mol Weight 215.25 g/mol
Molecular Formula C13H13NO2
Exact Mass 215.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E9f1NhsyQl2
Name 5-Cyanobicyclo[2.2.2]oct-3-oxo-7-ene-2-spiro-(2'-4'-methylene-oxolane)
Alternate Name(s) 3'-oxo-2-oxaspiro[bicyclo[2.1.1]hexane-5,2'-bicyclo[2.2.2]octan]-5'-ene-8'-carbonitrile x-cyanobicyclo[2.2.2]oct-3-oxo-7-ene-2-spiro-(2'-4'-methylene-oxolane)
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Formula C13H13NO2
InChI InChI=1S/C13H13NO2/c14-5-7-3-8-1-2-10(7)12(15)13(8)9-4-11(13)16-6-9/h1-2,7-11H,3-4,6H2/t7-,8-,9+,10+,11+,13+/m0/s1
InChIKey IPZBBWKANDUMLC-DQBXORCPSA-N
Molecular Weight 215.252 g/mol
SMILES [C@@]12(C([C@]3([C@@](C[C@@]2(C=C3)[H])(C#N)[H])[H])=O)[C@@]2(OC[C@]1(C2)[H])[H]
SPLASH splash10-0udr-9400000000-521698afa872dbfbbb8a
Source of Spectrum AD-0-3753-0
Wiley ID 27212