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acetic acid, (1H-benzimidazol-2-ylthio)-, 2-[(E)-(3-methylphenyl)methylidene]hydrazide
SpectraBase Compound ID 54TWiKNF5hA
InChI InChI=1S/C17H16N4OS/c1-12-5-4-6-13(9-12)10-18-21-16(22)11-23-17-19-14-7-2-3-8-15(14)20-17/h2-10H,11H2,1H3,(H,19,20)(H,21,22)/b18-10+
InChIKey LILWAMCLYBQBND-VCHYOVAHSA-N
Mol Weight 324.4 g/mol
Molecular Formula C17H16N4OS
Exact Mass 324.104482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4jD284FzXXf
Name Acetic acid, (1H-benzimidazol-2-ylthio)-, 2-[(E)-(3-methylphenyl)methylidene]hydrazide
Comments Computed using HOSE algorithm
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Exact Mass 324.104482324 u
Formula C17H16N4OS
InChI InChI=1S/C17H16N4OS/c1-12-5-4-6-13(9-12)10-18-21-16(22)11-23-17-19-14-7-2-3-8-15(14)20-17/h2-10H,11H2,1H3,(H,19,20)(H,21,22)/b18-10+
InChIKey LILWAMCLYBQBND-VCHYOVAHSA-N
SMILES N1C=2C=CC=CC2N=C1SCC(N\N=C\C=1C=C(C)C=CC1)=O