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N-((2S)-1-(1H-Benzo[D]imidazol-2-yl)-1-hydroxypropan-2-yl)picolinamide
SpectraBase Compound ID 17gVjhBhGlT
InChI InChI=1S/C16H16N4O2/c1-10(18-16(22)13-8-4-5-9-17-13)14(21)15-19-11-6-2-3-7-12(11)20-15/h2-10,14,21H,1H3,(H,18,22)(H,19,20)/t10-,14?/m0/s1
InChIKey MOHKHMKFUNYBHT-XLLULAGJSA-N
Mol Weight 296.33 g/mol
Molecular Formula C16H16N4O2
Exact Mass 296.127326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DbaJ7co5p5N
Name N-((2S)-1-(1H-Benzo[D]imidazol-2-yl)-1-hydroxypropan-2-yl)picolinamide
Comments Computed using HOSE algorithm
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Exact Mass 296.127325769 u
Formula C16H16N4O2
InChI InChI=1S/C16H16N4O2/c1-10(18-16(22)13-8-4-5-9-17-13)14(21)15-19-11-6-2-3-7-12(11)20-15/h2-10,14,21H,1H3,(H,18,22)(H,19,20)/t10-,14?/m0/s1
InChIKey MOHKHMKFUNYBHT-XLLULAGJSA-N
Molecular Weight 296.330 g/mol
SMILES C1(=CC=CC=N1)C(=O)N[C@](C(O)C=1NC2=C(N1)C=CC=C2)(C)[H]