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2-(4-Methylthio-phenyl)-4,4-dimethyl-pentane

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2-(4-Methylthio-phenyl)-4,4-dimethyl-pentane
SpectraBase Compound ID 89Hu0zLRcDS
InChI InChI=1S/C14H22S/c1-11(10-14(2,3)4)12-6-8-13(15-5)9-7-12/h6-9,11H,10H2,1-5H3
InChIKey XFPGTMVNIFECDS-UHFFFAOYSA-N
Mol Weight 222.39 g/mol
Molecular Formula C14H22S
Exact Mass 222.144222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hr3C8pc81bJ
Name 2-(4-Methylthio-phenyl)-4,4-dimethyl-pentane
CAS Registry Number 74362-61-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H22S
InChI InChI=1S/C14H22S/c1-11(10-14(2,3)4)12-6-8-13(15-5)9-7-12/h6-9,11H,10H2,1-5H3
InChIKey XFPGTMVNIFECDS-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference G. Fraenkel, J.M. Geckle, J. Am. Chem. Soc. 102, 2869 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3