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trans-1-benzylsulfonyl-2-phenylcyclopropane-1-carbonitrile
SpectraBase Compound ID G9PHI02cSsO
InChI InChI=1S/C17H15NO2S/c18-13-17(11-16(17)15-9-5-2-6-10-15)21(19,20)12-14-7-3-1-4-8-14/h1-10,16H,11-12H2/t16-,17+/m0/s1
InChIKey VOVPXDYOHYKEDH-DLBZAZTESA-N
Mol Weight 297.37 g/mol
Molecular Formula C17H15NO2S
Exact Mass 297.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GH3fyxx9sKC
Name trans-1-benzylsulfonyl-2-phenylcyclopropane-1-carbonitrile
Alternate Name(s) (1S,2S)-1-(benzylsulfonyl)-2-phenylcyclopropanecarbonitrile
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Formula C17H15NO2S
InChI InChI=1S/C17H15NO2S/c18-13-17(11-16(17)15-9-5-2-6-10-15)21(19,20)12-14-7-3-1-4-8-14/h1-10,16H,11-12H2/t16-,17+/m0/s1
InChIKey VOVPXDYOHYKEDH-DLBZAZTESA-N
Molecular Weight 297.372 g/mol
SMILES [C@]1(S(Cc2ccccc2)(=O)=O)([C@](c2ccccc2)(C1)[H])C#N
SPLASH splash10-0006-9100000000-6d770b7b1cd9900a4a8e
Source of Spectrum JA-49-243-0
Wiley ID 1300121