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(R)-2-Phenyl-2-(1-tosylpiperidin-4-yl)acetonitrile

View entire compound with spectra: 1 NMR

(R)-2-Phenyl-2-(1-tosylpiperidin-4-yl)acetonitrile
SpectraBase Compound ID CMfBJXJF8st
InChI InChI=1S/C20H22N2O2S/c1-16-7-9-19(10-8-16)25(23,24)22-13-11-18(12-14-22)20(15-21)17-5-3-2-4-6-17/h2-10,18,20H,11-14H2,1H3/t20-/m0/s1
InChIKey PDVZAILPIAKZQI-FQEVSTJZSA-N
Mol Weight 354.47 g/mol
Molecular Formula C20H22N2O2S
Exact Mass 354.140199 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6LeHkR7o2o
Name (R)-2-Phenyl-2-(1-tosylpiperidin-4-yl)acetonitrile
Comments Computed using HOSE algorithm
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Exact Mass 354.140199128 u
Formula C20H22N2O2S
InChI InChI=1S/C20H22N2O2S/c1-16-7-9-19(10-8-16)25(23,24)22-13-11-18(12-14-22)20(15-21)17-5-3-2-4-6-17/h2-10,18,20H,11-14H2,1H3/t20-/m0/s1
InChIKey PDVZAILPIAKZQI-FQEVSTJZSA-N
Molecular Weight 354.468 g/mol
SMILES C([C@](C1CCN(CC1)S(=O)(=O)C1=CC=C(C)C=C1)(C1=CC=CC=C1)[H])#N