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XYCDERWGFRWKSQ-UHFFFAOYSA-N

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XYCDERWGFRWKSQ-UHFFFAOYSA-N
SpectraBase Compound ID KTyiuHVruoP
InChI InChI=1S/C13H18OS/c1-10(2)13(4,11(3)14)15-12-8-6-5-7-9-12/h5-9,11,14H,1H2,2-4H3
InChIKey XYCDERWGFRWKSQ-UHFFFAOYSA-N
Mol Weight 222.35 g/mol
Molecular Formula C13H18OS
Exact Mass 222.107836 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KeX6cBqNX2A
Name XYCDERWGFRWKSQ-UHFFFAOYSA-N
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H18OS
InChI InChI=1S/C13H18OS/c1-10(2)13(4,11(3)14)15-12-8-6-5-7-9-12/h5-9,11,14H,1H2,2-4H3
InChIKey XYCDERWGFRWKSQ-UHFFFAOYSA-N
Literature Reference Author G.MARTIN,J.SAULEAU,M.DAVID,A.SAULEAU,S.SINBANDHIT
Literature Reference Citation CAN.J.CHEM.,70,2190(1992)
Literature Reference DOI 10.1139/v92-274
Molecular Weight 222.345 g/mol
Solvent CDCl3
Source File Reference UWVP402