| SpectraBase Spectrum ID |
I2x8RsYgVKw |
| Name |
1-Methyl-3-[2-(N-benzylamino)propionyl]-5-(methoxymethyl)-4-[(pyrrolidin-1-yl)carbonyl]-tetrahydroimidazol-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.226705458 u |
| Formula |
C21H30N4O4 |
| InChI |
InChI=1S/C21H30N4O4/c1-15(22-13-16-9-5-4-6-10-16)19(26)25-18(20(27)24-11-7-8-12-24)17(14-29-3)23(2)21(25)28/h4-6,9-10,15,17-18,22H,7-8,11-14H2,1-3H3 |
| InChIKey |
JSRPBKAUTDHKIU-UHFFFAOYSA-N |
| Molecular Weight |
402.495 g/mol |
| SMILES |
C1(N(C(C(N1C)COC)C(=O)N1CCCC1)C(=O)C(C)NCC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.854304 |
![1-Methyl-3-[2-(N-benzylamino)propionyl]-5-(methoxymethyl)-4-[(pyrrolidin-1-yl)carbonyl]-tetrahydroimidazol-2-one](/api/spectrum/I2x8RsYgVKw/structure.png?h=300&w=458 "1-Methyl-3-[2-(N-benzylamino)propionyl]-5-(methoxymethyl)-4-[(pyrrolidin-1-yl)carbonyl]-tetrahydroimidazol-2-one")
