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1-methyl-3-[[(3-methylbenzyl)thio]methyl]benzene
SpectraBase Compound ID J8SJW0w5ns
InChI InChI=1S/C16H18S/c1-13-5-3-7-15(9-13)11-17-12-16-8-4-6-14(2)10-16/h3-10H,11-12H2,1-2H3
InChIKey GFMUOQOMXUABTL-UHFFFAOYSA-N
Mol Weight 242.38 g/mol
Molecular Formula C16H18S
Exact Mass 242.112922 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3gjbVS69BaO
Name 1-methyl-3-[[(3-methylbenzyl)thio]methyl]benzene
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18S
InChI InChI=1S/C16H18S/c1-13-5-3-7-15(9-13)11-17-12-16-8-4-6-14(2)10-16/h3-10H,11-12H2,1-2H3
InChIKey GFMUOQOMXUABTL-UHFFFAOYSA-N
Literature Reference Author T.TAKEMURA,T.SATO
Literature Reference Citation CAN.J.CHEM.,54,3412(1976)
Literature Reference DOI 10.1139/v76-490
Molecular Weight 242.379 g/mol
Solvent CDCl3
Source File Reference UWED1976