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WSNDCQHQJNOZMR-OLQVQODUSA-N

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WSNDCQHQJNOZMR-OLQVQODUSA-N
SpectraBase Compound ID HKnKCPD8Wqi
InChI InChI=1S/C7H12O2S/c1-7(2)5-3-10(8,9)4-6(5)7/h5-6H,3-4H2,1-2H3/t5-,6+
InChIKey WSNDCQHQJNOZMR-OLQVQODUSA-N
Mol Weight 160.23 g/mol
Molecular Formula C7H12O2S
Exact Mass 160.055801 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4pambcAmyGH
Name WSNDCQHQJNOZMR-OLQVQODUSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H12O2S
InChI InChI=1S/C7H12O2S/c1-7(2)5-3-10(8,9)4-6(5)7/h5-6H,3-4H2,1-2H3/t5-,6+
InChIKey WSNDCQHQJNOZMR-OLQVQODUSA-N
Literature Reference Author J.M.ROULET,B.DEGUIN,P.VOGEL
Literature Reference Citation J.AM.CHEM.SOC.,116,3639(1994)
Literature Reference DOI 10.1021/ja00087a076
Molecular Weight 160.231 g/mol
Solvent CDCl3
Source File Reference UWSI3812