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4-ISOBUTYL-6-METHYL-1-PHENYL-4-(PHENYL-SULFONYL)-HEPTAN-3-OL
SpectraBase Compound ID 76uLqriZPXt
InChI InChI=1S/C24H34O3S/c1-19(2)17-24(18-20(3)4,28(26,27)22-13-9-6-10-14-22)23(25)16-15-21-11-7-5-8-12-21/h5-14,19-20,23,25H,15-18H2,1-4H3
InChIKey MEFIJDCJTBYQEG-UHFFFAOYSA-N
Mol Weight 402.6 g/mol
Molecular Formula C24H34O3S
Exact Mass 402.222866 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4PG0wvSMJos
Name 4-ISOBUTYL-6-METHYL-1-PHENYL-4-(PHENYL-SULFONYL)-HEPTAN-3-OL
Compound Number 15D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H34O3S
InChI InChI=1S/C24H34O3S/c1-19(2)17-24(18-20(3)4,28(26,27)22-13-9-6-10-14-22)23(25)16-15-21-11-7-5-8-12-21/h5-14,19-20,23,25H,15-18H2,1-4H3
InChIKey MEFIJDCJTBYQEG-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 402.592 g/mol
Solvent CDCl3
Source File Reference UWIR18655