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3-BENZYL-2-METHYLTHIO-5,6-DIHYDRO-(4H)-1,3-THIAZINIUM_IODIDE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-BENZYL-2-METHYLTHIO-5,6-DIHYDRO-(4H)-1,3-THIAZINIUM_IODIDE
SpectraBase Compound ID JjUcTcV7IZ1
InChI InChI=1S/C12H16NS2.HI/c1-14-12-13(8-5-9-15-12)10-11-6-3-2-4-7-11;/h2-4,6-7H,5,8-10H2,1H3;1H/q+1;/p-1
InChIKey TZMJZROKKPOQLN-UHFFFAOYSA-M
Mol Weight 365.29 g/mol
Molecular Formula C12H16INS2
Exact Mass 364.976887 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DP5lrs5OiY5
Name 3-BENZYL-2-METHYLTHIO-5,6-DIHYDRO-(4H)-1,3-THIAZINIUM_IODIDE
Compound Number 1A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16INS2
InChI InChI=1S/C12H16NS2.HI/c1-14-12-13(8-5-9-15-12)10-11-6-3-2-4-7-11;/h2-4,6-7H,5,8-10H2,1H3;1H/q+1;/p-1
InChIKey TZMJZROKKPOQLN-UHFFFAOYSA-M
Literature Reference Author W.HANEFELD,H.HARMS
Literature Reference Citation J.HETCYCL.CHEM.,34,1621(1997)
Literature Reference DOI 10.1002/jhet.5570340538
Molecular Weight 365.290 g/mol
Solvent CDCl3