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5-(5-PHENYLTETRAZOL-2-YL-METHYL)-4-PHENYL-S-TRIAZOLE-3-THIOL
SpectraBase Compound ID 6gNmW9QQrLN
InChI InChI=1S/C16H13N7S/c24-16-19-17-14(23(16)13-9-5-2-6-10-13)11-22-20-15(18-21-22)12-7-3-1-4-8-12/h1-10H,11H2,(H,19,24)
InChIKey AOVCLWRHKFHEIL-UHFFFAOYSA-N
Mol Weight 335.39 g/mol
Molecular Formula C16H13N7S
Exact Mass 335.095315 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E2qEvmpOjFG
Name 5-([5-Phenyl-2-tetrazolyl]-methyl)-4-phenyl-1,2,4-triazole-3-thiol
CAS Registry Number 75167-81-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H13N7S
InChI InChI=1S/C16H13N7S/c24-16-19-17-14(23(16)13-9-5-2-6-10-13)11-22-20-15(18-21-22)12-7-3-1-4-8-12/h1-10H,11H2,(H,19,24)
InChIKey AOVCLWRHKFHEIL-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference P.J. Kothari, V.I. Stenberg, S.P.Singh, J. Heterocycl. Chem. 17, 637 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6