| SpectraBase Compound ID | B8M2eZ7tvpd |
|---|---|
| InChI | InChI=1S/C12H18N2O/c1-4-7-13-12(15)14-11-8-9(2)5-6-10(11)3/h5-6,8H,4,7H2,1-3H3,(H2,13,14,15) |
| InChIKey | NDVDACOFVKOYCA-UHFFFAOYSA-N |
| Mol Weight | 206.29 g/mol |
| Molecular Formula | C12H18N2O |
| Exact Mass | 206.141913 g/mol |
Raman Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FYpF8iHpGir |
|---|---|
| Name | 1-Propyl-3-(2,5-xylyl)urea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 206.141913207 u |
| Formula | C12H18N2O |
| InChI | InChI=1S/C12H18N2O/c1-4-7-13-12(15)14-11-8-9(2)5-6-10(11)3/h5-6,8H,4,7H2,1-3H3,(H2,13,14,15) |
| InChIKey | NDVDACOFVKOYCA-UHFFFAOYSA-N |
| Molecular Weight | 206.289 g/mol |
| SMILES | N(C1=CC(=CC=C1C)C)C(NCCC)=O |
| Spectrum/Structure Validation Score (Raman) | 0.764622 |