SpectraBase Spectrum ID |
GpEOW7d1u1S |
Name |
Carbamic acid, (4,5-dihydro-1-methyl-4,5-dioxo-1H-imidazol-2-yl)-, 1,1-dimethylethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
227.090605907 u |
Formula |
C9H13N3O4 |
InChI |
InChI=1S/C9H13N3O4/c1-9(2,3)16-8(15)11-7-10-5(13)6(14)12(7)4/h1-4H3,(H,10,11,13,15) |
InChIKey |
LJZKDKGQLKGZCG-UHFFFAOYSA-N |
Molecular Weight |
227.220 g/mol |
SMILES |
C1(=NC(=O)C(N1C)=O)NC(OC(C)(C)C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970336 |