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METHYL-N-BUTYLSULFOXID

View entire compound with spectra: 3 NMR, and 2 MS (GC)

METHYL-N-BUTYLSULFOXID
SpectraBase Compound ID 1AOiUEJAWK8
InChI InChI=1S/C5H12OS/c1-3-4-5-7(2)6/h3-5H2,1-2H3
InChIKey QPKGDTBMWSPKDT-UHFFFAOYSA-N
Mol Weight 120.21 g/mol
Molecular Formula C5H12OS
Exact Mass 120.060886 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ou934BABo8
Name Methyl butyl sulphoxide
CAS Registry Number 2976-98-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H12OS
InChI InChI=1S/C5H12OS/c1-3-4-5-7(2)6/h3-5H2,1-2H3
InChIKey QPKGDTBMWSPKDT-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G. Barbarella, P. Dembech, A. Fava, Org. Magn. Resonance 8, 108 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3