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syn-4,4-Dimethyl-1-phenyl-2-(phenylsulfonyl)-1-pentanol

View entire compound with spectra: 1 NMR, 1 FTIR, and 2 MS (GC)

syn-4,4-Dimethyl-1-phenyl-2-(phenylsulfonyl)-1-pentanol
SpectraBase Compound ID DK7gO6A8IXL
InChI InChI=1S/C19H24O3S/c1-19(2,3)14-17(18(20)15-10-6-4-7-11-15)23(21,22)16-12-8-5-9-13-16/h4-13,17-18,20H,14H2,1-3H3
InChIKey LNDJKAVKMOEBEU-UHFFFAOYSA-N
Mol Weight 332.46 g/mol
Molecular Formula C19H24O3S
Exact Mass 332.144616 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4lGwbBHzQQ1
Name syn-4,4-Dimethyl-1-phenyl-2-(phenylsulfonyl)-1-pentanol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 332.144615804 u
Formula C19H24O3S
InChI InChI=1S/C19H24O3S/c1-19(2,3)14-17(18(20)15-10-6-4-7-11-15)23(21,22)16-12-8-5-9-13-16/h4-13,17-18,20H,14H2,1-3H3
InChIKey LNDJKAVKMOEBEU-UHFFFAOYSA-N
Molecular Weight 332.458 g/mol
SMILES C(S(=O)(=O)C1=CC=CC=C1)(C(C=1C=CC=CC1)O)CC(C)(C)C