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RPXUSEGLHQMSIM-UHFFFAOYSA-N

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RPXUSEGLHQMSIM-UHFFFAOYSA-N
SpectraBase Compound ID A7e6crYnSF
InChI InChI=1S/C8H8N4S/c1-13-8-9-10-11-12(8)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey RPXUSEGLHQMSIM-UHFFFAOYSA-N
Mol Weight 192.24 g/mol
Molecular Formula C8H8N4S
Exact Mass 192.046967 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Kp9A4LfD1Nl
Name 5-METHYLTHIO-1-PHENYL-1,2,3,4-TETRAZOLE
CAS Registry Number 1455-92-1
Compound Number 24A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H8N4S
InChI InChI=1S/C8H8N4S/c1-13-8-9-10-11-12(8)7-5-3-2-4-6-7/h2-6H,1H3
InChIKey RPXUSEGLHQMSIM-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 192.238 g/mol
Solvent DMSO-D6
Source File Reference UWCS13369