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DDFWKSYHQQOALW-UHFFFAOYSA-N
SpectraBase Compound ID WVjf5qNjIf
InChI InChI=1S/C8H17NO2S.ClH/c1-3-12(10,11)8-5-4-6-9(2)7-8;/h8H,3-7H2,1-2H3;1H
InChIKey DDFWKSYHQQOALW-UHFFFAOYSA-N
Mol Weight 227.75 g/mol
Molecular Formula C8H18ClNO2S
Exact Mass 227.074678 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A8XKopup8Cv
Name DDFWKSYHQQOALW-UHFFFAOYSA-N
CAS Registry Number 135626-00-5
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H18ClNO2S
InChI InChI=1S/C8H17NO2S.ClH/c1-3-12(10,11)8-5-4-6-9(2)7-8;/h8H,3-7H2,1-2H3;1H
InChIKey DDFWKSYHQQOALW-UHFFFAOYSA-N
Literature Reference Author C.ALVAREZ-IBARRA,R.CUERVO,M.C.FERNANDEZ-MONREAL,M.P.RUIZ
Literature Reference Citation J.ORG.CHEM.,57,4270(1992)
Literature Reference DOI 10.1021/jo00041a037
Molecular Weight 227.749 g/mol
Solvent DMSO-D6
Source File Reference UWCS1095