| SpectraBase Compound ID | 3rjfTmHFCG6 |
|---|---|
| InChI | InChI=1S/C13H20N2O/c1-3-10-15(11-4-2)13(16)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16) |
| InChIKey | LHXPKFQYXZREQC-UHFFFAOYSA-N |
| Mol Weight | 220.32 g/mol |
| Molecular Formula | C13H20N2O |
| Exact Mass | 220.157563 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | Bi9900gvWFE |
|---|---|
| Name | 1,1-Dipropyl-3-phenylurea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 220.157563271 u |
| Formula | C13H20N2O |
| InChI | InChI=1S/C13H20N2O/c1-3-10-15(11-4-2)13(16)14-12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3,(H,14,16) |
| InChIKey | LHXPKFQYXZREQC-UHFFFAOYSA-N |
| Molecular Weight | 220.316 g/mol |
| SMILES | N(C1=CC=CC=C1)C(N(CCC)CCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.979036 |