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2-(N-Maleimidomethyl-4'-benzamido)-6-pyridine

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

2-(N-Maleimidomethyl-4'-benzamido)-6-pyridine
SpectraBase Compound ID 21NiZnv2Oxb
InChI InChI=1S/C18H15N3O3/c1-12-3-2-4-15(19-12)20-18(24)14-7-5-13(6-8-14)11-21-16(22)9-10-17(21)23/h2-10H,11H2,1H3,(H,19,20,24)
InChIKey GCSAWTCZKFTEAL-UHFFFAOYSA-N
Mol Weight 321.34 g/mol
Molecular Formula C18H15N3O3
Exact Mass 321.111341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6dCrlPA2TiH
Name 2-(N-Maleimidomethyl-4'-benzamido)-6-pyridine
Comments Computed using HOSE algorithm
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Exact Mass 321.111341352 u
Formula C18H15N3O3
InChI InChI=1S/C18H15N3O3/c1-12-3-2-4-15(19-12)20-18(24)14-7-5-13(6-8-14)11-21-16(22)9-10-17(21)23/h2-10H,11H2,1H3,(H,19,20,24)
InChIKey GCSAWTCZKFTEAL-UHFFFAOYSA-N
Molecular Weight 321.336 g/mol
SMILES C1(N(C(C=C1)=O)CC=1C=CC(C(NC2=NC(C)=CC=C2)=O)=CC1)=O