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2-[5-Methyl-2-(4-phenyl-1,3-thiazol-2-yl)-1,2,4-triazol-3-yl]phenol

View entire compound with spectra: 1 NMR

2-[5-Methyl-2-(4-phenyl-1,3-thiazol-2-yl)-1,2,4-triazol-3-yl]phenol
SpectraBase Compound ID 6a2wfKSXoV2
InChI InChI=1S/C18H14N4OS/c1-12-19-17(14-9-5-6-10-16(14)23)22(21-12)18-20-15(11-24-18)13-7-3-2-4-8-13/h2-11,23H,1H3
InChIKey PQFYGHMLAKSBGX-UHFFFAOYSA-N
Mol Weight 334.4 g/mol
Molecular Formula C18H14N4OS
Exact Mass 334.088832 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KAssqAhgOOq
Name 2-[5-Methyl-2-(4-phenyl-1,3-thiazol-2-yl)-1,2,4-triazol-3-yl]phenol
Comments Computed using HOSE algorithm
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Exact Mass 334.088832260 u
Formula C18H14N4OS
InChI InChI=1S/C18H14N4OS/c1-12-19-17(14-9-5-6-10-16(14)23)22(21-12)18-20-15(11-24-18)13-7-3-2-4-8-13/h2-11,23H,1H3
InChIKey PQFYGHMLAKSBGX-UHFFFAOYSA-N
Molecular Weight 334.397 g/mol
SMILES C1(=CC=CC=C1)C=1N=C(SC1)N1C(C2=C(C=CC=C2)O)=NC(C)=N1