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3-PHENYL-5-METHYLPHENYLAMINO-1,2,3,4-THAITRIAZOLIUM_IODIDE
SpectraBase Compound ID CUbk0tlOuWI
InChI InChI=1S/C14H13N4S.HI/c1-17(12-8-4-2-5-9-12)14-15-18(16-19-14)13-10-6-3-7-11-13;/h2-11H,1H3;1H/q+1;/p-1
InChIKey DAQTWEQFYYTKMB-UHFFFAOYSA-M
Mol Weight 396.25 g/mol
Molecular Formula C14H13IN4S
Exact Mass 395.990563 g/mol

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

15N Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2wLm1hQnz8B
Name 3-PHENYL-1,2,3,4-THIATRIAZOLIUM-5-(N-METHYLANILINO)-IODIDE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13IN4S
InChI InChI=1S/C14H13N4S.HI/c1-17(12-8-4-2-5-9-12)14-15-18(16-19-14)13-10-6-3-7-11-13;/h2-11H,1H3;1H/q+1;/p-1
InChIKey DAQTWEQFYYTKMB-UHFFFAOYSA-M
Literature Reference Author J.JAZWINSKI,L.STEFANIAK
Literature Reference Citation MAGN.RES.CHEM.,31,447(1993)
Literature Reference DOI 10.1002/mrc.1260310506
Solvent DMSO-D6(0.1-0.5M)
Source File Reference UWMR472