| SpectraBase Compound ID | KssJrhDy6NO |
|---|---|
| InChI | InChI=1S/C9H16N2O2/c1-7-10-5-6-11(7)8(12)13-9(2,3)4/h5-6H2,1-4H3 |
| InChIKey | LHBIJMRVOQQYIK-UHFFFAOYSA-N |
| Mol Weight | 184.24 g/mol |
| Molecular Formula | C9H16N2O2 |
| Exact Mass | 184.121178 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ApPWFERTPGY |
|---|---|
| Name | Tert-butyl 2-methyl-4,5-dihydroimidazole-1-carboxylate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 184.121177761 u |
| Formula | C9H16N2O2 |
| InChI | InChI=1S/C9H16N2O2/c1-7-10-5-6-11(7)8(12)13-9(2,3)4/h5-6H2,1-4H3 |
| InChIKey | LHBIJMRVOQQYIK-UHFFFAOYSA-N |
| Molecular Weight | 184.239 g/mol |
| SMILES | C(OC(C)(C)C)(N1CCN=C1C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.883014 |