| SpectraBase Compound ID | BtPIFFDtqzA |
|---|---|
| InChI | InChI=1S/C14H13BrN2O/c15-12-7-4-8-13(9-12)17-14(18)16-10-11-5-2-1-3-6-11/h1-9H,10H2,(H2,16,17,18) |
| InChIKey | FCQDKPQLOZVJPD-UHFFFAOYSA-N |
| Mol Weight | 305.18 g/mol |
| Molecular Formula | C14H13BrN2O |
| Exact Mass | 304.021126 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 82DsgJxtLuz |
|---|---|
| Name | 1-Benzyl-3-(m-bromophenyl)urea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 304.021126046 u |
| Formula | C14H13BrN2O |
| InChI | InChI=1S/C14H13BrN2O/c15-12-7-4-8-13(9-12)17-14(18)16-10-11-5-2-1-3-6-11/h1-9H,10H2,(H2,16,17,18) |
| InChIKey | FCQDKPQLOZVJPD-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC(=C1)Br)C(NCC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) | 0.721519 |