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3-(Triphenylmethyl)-1-(phenylsulfonyl)cyclohexene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(Triphenylmethyl)-1-(phenylsulfonyl)cyclohexene
SpectraBase Compound ID BJTiio4sMDQ
InChI InChI=1S/C31H28O2S/c32-34(33,29-21-11-4-12-22-29)30-23-13-20-28(24-30)31(25-14-5-1-6-15-25,26-16-7-2-8-17-26)27-18-9-3-10-19-27/h1-12,14-19,21-22,24,28H,13,20,23H2
InChIKey ZPIUTIUZVPYBPT-UHFFFAOYSA-N
Mol Weight 464.62 g/mol
Molecular Formula C31H28O2S
Exact Mass 464.181001 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EGZH2YPZa8y
Name 3-(Triphenylmethyl)-1-(phenylsulfonyl)cyclohexene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.181001314 u
Formula C31H28O2S
InChI InChI=1S/C31H28O2S/c32-34(33,29-21-11-4-12-22-29)30-23-13-20-28(24-30)31(25-14-5-1-6-15-25,26-16-7-2-8-17-26)27-18-9-3-10-19-27/h1-12,14-19,21-22,24,28H,13,20,23H2
InChIKey ZPIUTIUZVPYBPT-UHFFFAOYSA-N
Molecular Weight 464.623 g/mol
SMILES C1(S(=O)(=O)C=2C=CC=CC2)=CC(C(C=2C=CC=CC2)(C=2C=CC=CC2)C=2C=CC=CC2)CCC1