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1,3,4-Thiadiazole, 2-(4-dimethylaminobenzylidenamino)-5-phenyl-

View entire compound with spectra: 2 NMR, and 1 MS (GC)

1,3,4-Thiadiazole, 2-(4-dimethylaminobenzylidenamino)-5-phenyl-
SpectraBase Compound ID 9cpGrSdoH5v
InChI InChI=1S/C17H16N4S/c1-21(2)15-10-8-13(9-11-15)12-18-17-20-19-16(22-17)14-6-4-3-5-7-14/h3-12H,1-2H3/b18-12+
InChIKey COFKGFMXENMDLN-LDADJPATSA-N
Mol Weight 308.4 g/mol
Molecular Formula C17H16N4S
Exact Mass 308.109568 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AfRcpsMLtSP
Name 1,3,4-Thiadiazole, 2-(4-dimethylaminobenzylidenamino)-5-phenyl-
Comments Computed using HOSE algorithm
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Exact Mass 308.109567705 u
Formula C17H16N4S
InChI InChI=1S/C17H16N4S/c1-21(2)15-10-8-13(9-11-15)12-18-17-20-19-16(22-17)14-6-4-3-5-7-14/h3-12H,1-2H3/b18-12+
InChIKey COFKGFMXENMDLN-LDADJPATSA-N
Molecular Weight 308.403 g/mol
SMILES C1=CC=C(C=2SC(\N=C\C3=CC=C(N(C)C)C=C3)=NN2)C=C1