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2-[(1R,2S)-2-(phenylcarbonyl)cyclopropyl]ethanenitrile
SpectraBase Compound ID vilik7OnYn
InChI InChI=1S/C12H11NO/c13-7-6-10-8-11(10)12(14)9-4-2-1-3-5-9/h1-5,10-11H,6,8H2/t10-,11-/m0/s1
InChIKey OFLKAUZKVLWTIZ-QWRGUYRKSA-N
Mol Weight 185.23 g/mol
Molecular Formula C12H11NO
Exact Mass 185.084064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AtrAiJoLuGl
Name 2-[(1R,2S)-2-(phenylcarbonyl)cyclopropyl]ethanenitrile
Alternate Name(s) 2-[(1R,2S)-2-benzoylcyclopropyl]acetonitrile
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Formula C12H11NO
InChI InChI=1S/C12H11NO/c13-7-6-10-8-11(10)12(14)9-4-2-1-3-5-9/h1-5,10-11H,6,8H2/t10-,11-/m0/s1
InChIKey OFLKAUZKVLWTIZ-QWRGUYRKSA-N
Molecular Weight 185.226 g/mol
SMILES [C@]1(C[C@@]1(CC#N)[H])(C(=O)c1ccccc1)[H]
SPLASH splash10-0a6r-1900000000-82d8c6c9910267a08a6f
Source of Spectrum J-67-3144-9
Wiley ID 1569768