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2-METHYL-1-PROPYL,2-METHYL-1-PROPANETHIOLSULFONATE
SpectraBase Compound ID CP5pFFzxrKK
InChI InChI=1S/C8H18O2S2/c1-7(2)5-11-12(9,10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKey CUGQAFJZTZJGNU-UHFFFAOYSA-N
Mol Weight 210.35 g/mol
Molecular Formula C8H18O2S2
Exact Mass 210.074822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ao2sAAn8Gm8
Name 2-METHYLTHIO-1-PROPANESULFONIC ACID, S-ISOBUTYL ESTER
Source of Sample S. W. Bass, S. A. Evans J. Org. Chem. 45, 710(1980)
CAS Registry Number 59917-29-2
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H18O2S2
InChI InChI=1S/C8H18O2S2/c1-7(2)5-11-12(9,10)6-8(3)4/h7-8H,5-6H2,1-4H3
InChIKey CUGQAFJZTZJGNU-UHFFFAOYSA-N
Molecular Weight 210.36
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Varian XL-100
Synonyms 1-PROPANESULFONIC ACID, 2-METHYLTHIO-, S-ISOBUTYL ESTER