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2-[BIS-(METHYLTHIO)-METHYLENEAMINO]-1-METHYL-1H-BENZO-[D]-IMIDAZOL-3-IUM-IODIDE
SpectraBase Compound ID KzyK0wtOuut
InChI InChI=1S/C11H13N3S2.HI/c1-14-9-7-5-4-6-8(9)12-10(14)13-11(15-2)16-3;/h4-7H,1-3H3;1H
InChIKey KVDPZKAOEPCXMM-UHFFFAOYSA-N
Mol Weight 379.28 g/mol
Molecular Formula C11H14IN3S2
Exact Mass 378.967385 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Aixu7jvckoj
Name 2-[BIS-(METHYLTHIO)-METHYLENEAMINO]-1-METHYL-1H-BENZO-[D]-IMIDAZOL-3-IUM-IODIDE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14IN3S2
InChI InChI=1S/C11H13N3S2.HI/c1-14-9-7-5-4-6-8(9)12-10(14)13-11(15-2)16-3;/h4-7H,1-3H3;1H
InChIKey KVDPZKAOEPCXMM-UHFFFAOYSA-N
Literature Reference Author A.CRUZ,I.I.PADILLA-MARTINEZ,E.V.GARCIA-BAEZ,G.GUERRERO-MUNOZ
Literature Reference Citation MOLECULES,19,13878(2014)
Literature Reference DOI 10.3390/molecules190913878
Molecular Weight 379.277 g/mol
Solvent DMSO-D6
Source File Reference UWIR15340