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3-ETHYL-5-METHYLTHIO-1-PHENYL-1,2,3,4-TETRAZOLIUM-TETRAFLUOROBORATE

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3-ETHYL-5-METHYLTHIO-1-PHENYL-1,2,3,4-TETRAZOLIUM-TETRAFLUOROBORATE
SpectraBase Compound ID 5jMtK3blSHg
InChI InChI=1S/C10H13N4S.BF4/c1-3-13-11-10(15-2)14(12-13)9-7-5-4-6-8-9;2-1(3,4)5/h4-8H,3H2,1-2H3;/q+1;-1
InChIKey HOFKZRVJQBGNGL-UHFFFAOYSA-N
Mol Weight 308.11 g/mol
Molecular Formula C10H13BF4N4S
Exact Mass 308.08901 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7j2DNOLOZko
Name 3-ETHYL-5-METHYLTHIO-1-PHENYL-1,2,3,4-TETRAZOLIUM-TETRAFLUOROBORATE
CAS Registry Number 62638-94-2
Compound Number 27
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H13BF4N4S
InChI InChI=1S/C10H13N4S.BF4/c1-3-13-11-10(15-2)14(12-13)9-7-5-4-6-8-9;2-1(3,4)5/h4-8H,3H2,1-2H3;/q+1;-1
InChIKey HOFKZRVJQBGNGL-UHFFFAOYSA-N
Literature Reference Author J.R.BARTELS-KEITH,M.T.BURGESS,J.M.STEVENSON
Literature Reference Citation J.ORG.CHEM.,42,3725(1977)
Literature Reference DOI 10.1021/jo00443a020
Molecular Weight 308.104 g/mol
Solvent DMSO-D6
Source File Reference UWCS13374