| SpectraBase Spectrum ID |
C61jjhdnQfL |
| Name |
5-(Benzylamino)-1-[(3,5-dimethylphenyl)methyl]-3H-pyrimidine-2,4-dione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
335.163376926 u |
| Formula |
C20H21N3O2 |
| InChI |
InChI=1S/C20H21N3O2/c1-14-8-15(2)10-17(9-14)12-23-13-18(19(24)22-20(23)25)21-11-16-6-4-3-5-7-16/h3-10,13,21H,11-12H2,1-2H3,(H,22,24,25) |
| InChIKey |
HLFISNDNBPDDGX-UHFFFAOYSA-N |
| Molecular Weight |
335.407 g/mol |
| SMILES |
C1(N(C=C(C(N1)=O)NCC1=CC=CC=C1)CC1=CC(=CC(=C1)C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92178 |
![5-(Benzylamino)-1-[(3,5-dimethylphenyl)methyl]-3H-pyrimidine-2,4-dione](/api/spectrum/C61jjhdnQfL/structure.png?h=300&w=458 "5-(Benzylamino)-1-[(3,5-dimethylphenyl)methyl]-3H-pyrimidine-2,4-dione")
