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1-PHENYL-4-{[(1-PHENYL-1H-TETRAZOL-5-YL)THIO]METHYL}-2-TETRAZOLIN-5-ONE

View entire compound with spectra: 2 NMR

1-PHENYL-4-{[(1-PHENYL-1H-TETRAZOL-5-YL)THIO]METHYL}-2-TETRAZOLIN-5-ONE
SpectraBase Compound ID ESJC5T6fP42
InChI InChI=1S/C15H12N8OS/c24-15-21(19-20-23(15)13-9-5-2-6-10-13)11-25-14-16-17-18-22(14)12-7-3-1-4-8-12/h1-10H,11H2
InChIKey YRYFIVKOMNFDCM-UHFFFAOYSA-N
Mol Weight 352.38 g/mol
Molecular Formula C15H12N8OS
Exact Mass 352.085478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HBCb9DGu7s
Name 1-PHENYL-4-{[(1-PHENYL-1H-TETRAZOL-5-YL)THIO]METHYL}-2-TETRAZOLIN-5-ONE
Source of Sample W. Tochtermann, H. Gustmann Chem. Ber. 111, 566(1978)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12N8OS
InChI InChI=1S/C15H12N8OS/c24-15-21(19-20-23(15)13-9-5-2-6-10-13)11-25-14-16-17-18-22(14)12-7-3-1-4-8-12/h1-10H,11H2
InChIKey YRYFIVKOMNFDCM-UHFFFAOYSA-N
Molecular Weight 352.38
Solvent Dimethyl sulfoxide-d6; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-90
Synonyms 2-TETRAZOLIN-5-ONE, 1-PHENYL- 4-///1-PHENYL-1H-TETRAZOL-5-YL/THIO/METHYL/-,