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6,6-Dimethoxy-5-oxo-8-phenylbicyclo[2.2.2]oct-2-en-2-yl cyanide
SpectraBase Compound ID CHo2cnVZ810
InChI InChI=1S/C17H17NO3/c1-20-17(21-2)15-9-13(11-6-4-3-5-7-11)14(16(17)19)8-12(15)10-18/h3-8,13-15H,9H2,1-2H3/t13-,14+,15+/m1/s1
InChIKey YIFOBVSBHHIIGE-ILXRZTDVSA-N
Mol Weight 283.33 g/mol
Molecular Formula C17H17NO3
Exact Mass 283.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ckNqyVVDG0
Name 6,6-Dimethoxy-5-oxo-8-phenylbicyclo[2.2.2]oct-2-en-2-yl cyanide
Alternate Name(s) (1S*,4R*,7R*)-6,6-Dimethoxy-5-oxo-8-phenylbicyclo[2.2.2]oct-2-en-2-yl cyanide 6,6-Dimethoxy-5-oxo-8-phenylbicyclo[2.2.2]oct-2-ene-2-carbonitrile
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Formula C17H17NO3
InChI InChI=1S/C17H17NO3/c1-20-17(21-2)15-9-13(11-6-4-3-5-7-11)14(16(17)19)8-12(15)10-18/h3-8,13-15H,9H2,1-2H3/t13-,14+,15+/m1/s1
InChIKey YIFOBVSBHHIIGE-ILXRZTDVSA-N
Molecular Weight 283.327 g/mol
SMILES C1(C([C@@]2([C@](C[C@]1(C(=C2)C#N)[H])(c1ccccc1)[H])[H])=O)(OC)OC
SPLASH splash10-0a4i-1490000000-9ed1822f175065f4ff88
Source of Spectrum F-57-307-6
Wiley ID 1549202