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2-METHYL-1-(TERT.-BUTYLSULFINYL)-NAPHTHALENE;MAJOR-ROTAMER
SpectraBase Compound ID GQrtOjq7Xz2
InChI InChI=1S/C15H18OS/c1-11-9-10-12-7-5-6-8-13(12)14(11)17(16)15(2,3)4/h5-10H,1-4H3
InChIKey PPHFMWKESPDTGS-UHFFFAOYSA-N
Mol Weight 246.37 g/mol
Molecular Formula C15H18OS
Exact Mass 246.107836 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GO5iPYg7hbD
Name 2-METHYL-1-(TERT.-BUTYLSULFINYL)-NAPHTHALENE;MAJOR-ROTAMER
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c1-11-9-10-12-7-5-6-8-13(12)14(11)17(16)15(2,3)4/h5-10H,1-4H3
InChIKey PPHFMWKESPDTGS-UHFFFAOYSA-N
Literature Reference Author R.W.BAKER,R.V.KYASNOOR,M.V.SARGENT
Literature Reference Citation J.CHEM.SOC.PERKIN-2,1333(1998)
Literature Reference DOI 10.1039/a801322e
Molecular Weight 246.367 g/mol
Solvent CDCl3
Source File Reference UWRU12252