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3-(benzyl)-1,3-benzothiazol-3-ium
SpectraBase Compound ID Agnu4fHaZXr
InChI InChI=1S/C14H12NS/c1-2-6-12(7-3-1)10-15-11-16-14-9-5-4-8-13(14)15/h1-9,11H,10H2/q+1
InChIKey DUYUXBIGMDWPQH-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C14H12NS
Exact Mass 226.069046 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E9KfWYevYZD
Name 3-(benzyl)-1,3-benzothiazol-3-ium
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12NS
InChI InChI=1S/C14H12NS/c1-2-6-12(7-3-1)10-15-11-16-14-9-5-4-8-13(14)15/h1-9,11H,10H2/q+1
InChIKey DUYUXBIGMDWPQH-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 226.316 g/mol
Source File Reference MHKO20515