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2-(benzylamino)-N-p-tolylnicotinamide
SpectraBase Compound ID HEXNdiWLTdJ
InChI InChI=1S/C20H19N3O/c1-15-9-11-17(12-10-15)23-20(24)18-8-5-13-21-19(18)22-14-16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,21,22)(H,23,24)
InChIKey CKGDBPXBUKTJQP-UHFFFAOYSA-N
Mol Weight 317.39 g/mol
Molecular Formula C20H19N3O
Exact Mass 317.152812 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID DkqXpsLe5e7
Name 2-(Benzylamino)-N-p-tolylnicotinamide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 317.152812243 u
Formula C20H19N3O
InChI InChI=1S/C20H19N3O/c1-15-9-11-17(12-10-15)23-20(24)18-8-5-13-21-19(18)22-14-16-6-3-2-4-7-16/h2-13H,14H2,1H3,(H,21,22)(H,23,24)
InChIKey CKGDBPXBUKTJQP-UHFFFAOYSA-N
Molecular Weight 317.392 g/mol
SMILES N(C1=C(C(NC=2C=CC(=CC2)C)=O)C=CC=N1)CC=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.833374