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4-phenyl-2-tetrazoline-5-thione

View entire compound with spectra: 23 NMR, 4 FTIR, 1 Raman, 2 UV-Vis, and 4 MS (GC)

4-phenyl-2-tetrazoline-5-thione
SpectraBase Compound ID 6aUUHgBP4X2
InChI InChI=1S/C7H6N4S/c12-7-8-9-10-11(7)6-4-2-1-3-5-6/h1-5H,(H,8,10,12)
InChIKey GGZHVNZHFYCSEV-UHFFFAOYSA-N
Mol Weight 178.21 g/mol
Molecular Formula C7H6N4S
Exact Mass 178.031317 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Nd7utFb2Tw
Name 1-Phenyl-tetrazole-5-thiole
CAS Registry Number 86-93-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H6N4S
InChI InChI=1S/C7H6N4S/c12-7-8-9-10-11(7)6-4-2-1-3-5-6/h1-5H,(H,8,10,12)
InChIKey GGZHVNZHFYCSEV-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference W. Tochtermann, H. Gustmann, Chem. Ber. 111, 566 (1978).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6