| SpectraBase Compound ID | 7LXN3QaH4Rm |
|---|---|
| InChI | InChI=1S/C15H16N2O/c18-15(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,16,17,18) |
| InChIKey | KATOLVAXCGIBLO-UHFFFAOYSA-N |
| Mol Weight | 240.31 g/mol |
| Molecular Formula | C15H16N2O |
| Exact Mass | 240.126263 g/mol |
| SpectraBase Spectrum ID | GUG67ly5yy0 |
|---|---|
| Name | 1,3-Dibenzylurea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 240.126263142 u |
| Formula | C15H16N2O |
| InChI | InChI=1S/C15H16N2O/c18-15(16-11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2,(H2,16,17,18) |
| InChIKey | KATOLVAXCGIBLO-UHFFFAOYSA-N |
| Molecular Weight | 240.306 g/mol |
| SMILES | N(CC1=CC=CC=C1)C(NCC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) | 0.988778 |