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2-(Benzenesulfonyl)-3(R)-(cyclohexen-1-yl)-2-methyl-cyclopentanone
SpectraBase Compound ID 2PMeZtvbOZc
InChI InChI=1S/C18H22O3S/c1-18(22(20,21)15-10-6-3-7-11-15)16(12-13-17(18)19)14-8-4-2-5-9-14/h3,6-8,10-11,16H,2,4-5,9,12-13H2,1H3
InChIKey GIPXXAVIKYRUFT-UHFFFAOYSA-N
Mol Weight 318.43 g/mol
Molecular Formula C18H22O3S
Exact Mass 318.128966 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AU6aJxvrEra
Name 2-(Benzenesulfonyl)-3(R)-(cyclohexen-1-yl)-2-methyl-cyclopentanone
CAS Registry Number 79707-87-2
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H22O3S
InChI InChI=1S/C18H22O3S/c1-18(22(20,21)15-10-6-3-7-11-15)16(12-13-17(18)19)14-8-4-2-5-9-14/h3,6-8,10-11,16H,2,4-5,9,12-13H2,1H3
InChIKey GIPXXAVIKYRUFT-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference B.M. Trost, T.A. Runge, J. Am. Chem. Soc. 103, 7550 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Benzene-D6