| SpectraBase Compound ID | JMuW6CpBa33 |
|---|---|
| InChI | InChI=1S/C9H11N3O3/c1-11(2)9(13)10-7-4-3-5-8(6-7)12(14)15/h3-6H,1-2H3,(H,10,13) |
| InChIKey | FRDCRCKHAAQIRU-UHFFFAOYSA-N |
| Mol Weight | 209.2 g/mol |
| Molecular Formula | C9H11N3O3 |
| Exact Mass | 209.080041 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 7aIGEkVZ5gO |
|---|---|
| Name | 1,1-Dimethyl-3-(m-nitrophenyl)urea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 209.080041223 u |
| Formula | C9H11N3O3 |
| InChI | InChI=1S/C9H11N3O3/c1-11(2)9(13)10-7-4-3-5-8(6-7)12(14)15/h3-6H,1-2H3,(H,10,13) |
| InChIKey | FRDCRCKHAAQIRU-UHFFFAOYSA-N |
| Molecular Weight | 209.205 g/mol |
| SMILES | N(=O)(=O)C1=CC(=CC=C1)NC(N(C)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.932621 |