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PXUQRJQZAIRMKN-UHFFFAOYSA-M

View entire compound with spectra: 3 NMR

PXUQRJQZAIRMKN-UHFFFAOYSA-M
SpectraBase Compound ID BmNavnsEUFe
InChI InChI=1S/C11H14N3S.HI/c1-13-10(9-7-5-4-6-8-9)14(2)12-11(13)15-3;/h4-8H,1-3H3;1H/q+1;/p-1
InChIKey PXUQRJQZAIRMKN-UHFFFAOYSA-M
Mol Weight 347.22 g/mol
Molecular Formula C11H14IN3S
Exact Mass 346.995314 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J5JLCgbx2UK
Name 1,3-DIMETHYL-2-PHENYL-5-METHYLMERCAPTO-1,3,4-TRIAZOLIUM_IODIDE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14IN3S
InChI InChI=1S/C11H14N3S.HI/c1-13-10(9-7-5-4-6-8-9)14(2)12-11(13)15-3;/h4-8H,1-3H3;1H/q+1;/p-1
InChIKey PXUQRJQZAIRMKN-UHFFFAOYSA-M
Literature Reference Author L.STEFANIAK,J.JAZWINSKI
Literature Reference Citation CHEM.HET.COMP.,31,1027(1995)
Literature Reference DOI 10.1007/bf01165049
Solvent DMSO-D6
Source File Reference UWMZ14879