| SpectraBase Compound ID | KjX6itzH4vT |
|---|---|
| InChI | InChI=1S/C11H16N2O/c1-8-6-5-7-10(9(8)2)12-11(14)13(3)4/h5-7H,1-4H3,(H,12,14) |
| InChIKey | SPUOBPMIQGRBBS-UHFFFAOYSA-N |
| Mol Weight | 192.26 g/mol |
| Molecular Formula | C11H16N2O |
| Exact Mass | 192.126263 g/mol |
| SpectraBase Spectrum ID | ESjnHgowLDl |
|---|---|
| Name | 1,1-Dimethyl-3-(2,3-xylyl)urea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 192.126263142 u |
| Formula | C11H16N2O |
| InChI | InChI=1S/C11H16N2O/c1-8-6-5-7-10(9(8)2)12-11(14)13(3)4/h5-7H,1-4H3,(H,12,14) |
| InChIKey | SPUOBPMIQGRBBS-UHFFFAOYSA-N |
| Molecular Weight | 192.262 g/mol |
| SMILES | N(C1=CC=CC(=C1C)C)C(N(C)C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.959263 |