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CPASVMWZZYTAIB-UHFFFAOYSA-N
SpectraBase Compound ID 1s9oiFeEdE
InChI InChI=1S/C16H16O2S/c1-2-9-19-10-16(18)13-8-4-6-11-5-3-7-12(14(11)13)15(16)17/h3-8,18H,2,9-10H2,1H3
InChIKey CPASVMWZZYTAIB-UHFFFAOYSA-N
Mol Weight 272.36 g/mol
Molecular Formula C16H16O2S
Exact Mass 272.087101 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6bvR58ciag2
Name CPASVMWZZYTAIB-UHFFFAOYSA-N
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16O2S
InChI InChI=1S/C16H16O2S/c1-2-9-19-10-16(18)13-8-4-6-11-5-3-7-12(14(11)13)15(16)17/h3-8,18H,2,9-10H2,1H3
InChIKey CPASVMWZZYTAIB-UHFFFAOYSA-N
Literature Reference Author U.C.YOON,Y.C.KIM,J.J.CHOI,D.U.KIM,P.S.MARIANO,I.S.CHO,Y.T.JE ON
Literature Reference Citation J.ORG.CHEM.,57,1422(1992)
Literature Reference DOI 10.1021/jo00031a020
Molecular Weight 272.362 g/mol
Solvent CDCl3
Source File Reference UWCS2114