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CKXNUAJICLQOGQ-UHFFFAOYSA-N
SpectraBase Compound ID 2J3ekxtGVwc
InChI InChI=1S/C9H14O4S/c1-3-14-5-4-13-8(10)6-7(2)9(11)12/h2-6H2,1H3,(H,11,12)
InChIKey CKXNUAJICLQOGQ-UHFFFAOYSA-N
Mol Weight 218.27 g/mol
Molecular Formula C9H14O4S
Exact Mass 218.06128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GVlMxxuSgzG
Name CKXNUAJICLQOGQ-UHFFFAOYSA-N
Compound Number 3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H14O4S
InChI InChI=1S/C9H14O4S/c1-3-14-5-4-13-8(10)6-7(2)9(11)12/h2-6H2,1H3,(H,11,12)
InChIKey CKXNUAJICLQOGQ-UHFFFAOYSA-N
Literature Reference Author E.DOMINGUEZ,C.LABORRA,A.LINAZA,A.MADOZ,I.A.KATIME
Literature Reference Citation MH.CHEM.,120,743(1989)
Literature Reference DOI 10.1007/BF00809967
Molecular Weight 218.268 g/mol
Solvent CDCl3
Source File Reference UWRU9107