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2-[(4-METHYL-PHENYLTHIO-BENZOYL)-METHYLIDENE]-1,3-DITHIOLANE
SpectraBase Compound ID IbHBGBAHjaO
InChI InChI=1S/C18H16OS3/c1-13-7-9-15(10-8-13)22-17(18-20-11-12-21-18)16(19)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey MODYHCXGBDWURL-UHFFFAOYSA-N
Mol Weight 344.51 g/mol
Molecular Formula C18H16OS3
Exact Mass 344.036329 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6l7n9yuvOiO
Name 2-[(4-METHYL-PHENYLTHIO-BENZOYL)-METHYLIDENE]-1,3-DITHIOLANE
Compound Number 1B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H16OS3
InChI InChI=1S/C18H16OS3/c1-13-7-9-15(10-8-13)22-17(18-20-11-12-21-18)16(19)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3
InChIKey MODYHCXGBDWURL-UHFFFAOYSA-N
Literature Reference Author E.KLEINPETER,S.THOMAS,G.UHLIG,W.D.RUDORF
Literature Reference Citation MAGN.RES.CHEM.,31,714(1993)
Literature Reference DOI 10.1002/mrc.1260310805
Molecular Weight 344.504 g/mol
Solvent CDCl3:TMS
Source File Reference UWRK1179