| SpectraBase Spectrum ID |
BwgKRjVpvtO |
| Name |
Methyl 1-(3'-amino-4'-methylphenyl)-2,5-dioxoimidazolidine-4-acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
277.106255971 u |
| Formula |
C13H15N3O4 |
| InChI |
InChI=1S/C13H15N3O4/c1-7-3-4-8(5-9(7)14)16-12(18)10(15-13(16)19)6-11(17)20-2/h3-5,10H,6,14H2,1-2H3,(H,15,19) |
| InChIKey |
BZYFWUAQMKYYJU-UHFFFAOYSA-N |
| SMILES |
C1(N(C(C(N1)CC(=O)OC)=O)C=1C=C(N)C(=CC1)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.924117 |
