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2-phenyl-2-(phenylsulfanyl)-N-(1H-1,2,4-triazol-3-yl)acetamide

View entire compound with spectra: 2 NMR

2-phenyl-2-(phenylsulfanyl)-N-(1H-1,2,4-triazol-3-yl)acetamide
SpectraBase Compound ID Ankr7RYML3f
InChI InChI=1S/C16H14N4OS/c21-15(19-16-17-11-18-20-16)14(12-7-3-1-4-8-12)22-13-9-5-2-6-10-13/h1-11,14H,(H2,17,18,19,20,21)
InChIKey SZTSSLNVSLQFRC-UHFFFAOYSA-N
Mol Weight 310.37 g/mol
Molecular Formula C16H14N4OS
Exact Mass 310.088832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G04N6UWAO30
Name 2-Phenyl-2-(phenylsulfanyl)-N-(1H-1,2,4-triazol-3-yl)acetamide
Comments Computed using HOSE algorithm
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Exact Mass 310.088832260 u
Formula C16H14N4OS
InChI InChI=1S/C16H14N4OS/c21-15(19-16-17-11-18-20-16)14(12-7-3-1-4-8-12)22-13-9-5-2-6-10-13/h1-11,14H,(H2,17,18,19,20,21)
InChIKey SZTSSLNVSLQFRC-UHFFFAOYSA-N
Molecular Weight 310.375 g/mol
SMILES N1C=NC(NC(C(SC2=CC=CC=C2)C2=CC=CC=C2)=O)=N1