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3-ETHYL-3-(PHENYL-SULFONYL)-NON-4-YL-BENZOATE

View entire compound with spectra: 1 NMR

3-ETHYL-3-(PHENYL-SULFONYL)-NON-4-YL-BENZOATE
SpectraBase Compound ID K8zbcQGYNfo
InChI InChI=1S/C24H32O4S/c1-4-7-10-19-22(28-23(25)20-15-11-8-12-16-20)24(5-2,6-3)29(26,27)21-17-13-9-14-18-21/h8-9,11-18,22H,4-7,10,19H2,1-3H3
InChIKey GRXNJGRJYJCMQA-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C24H32O4S
Exact Mass 416.202131 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 97W0mNYEWpx
Name 3-ETHYL-3-(PHENYL-SULFONYL)-NON-4-YL-BENZOATE
Compound Number 17E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H32O4S
InChI InChI=1S/C24H32O4S/c1-4-7-10-19-22(28-23(25)20-15-11-8-12-16-20)24(5-2,6-3)29(26,27)21-17-13-9-14-18-21/h8-9,11-18,22H,4-7,10,19H2,1-3H3
InChIKey GRXNJGRJYJCMQA-UHFFFAOYSA-N
Literature Reference Author L.REHOVA,I.CISAROVA,U.JAHN
Literature Reference Citation EUR.J.ORG.CHEM.,2014,1461(2014)
Literature Reference DOI 10.1002/ejoc.201301553
Molecular Weight 416.576 g/mol
Solvent CDCl3
Source File Reference UWIR18663