| SpectraBase Compound ID | AHbHv53IZr2 |
|---|---|
| InChI | InChI=1S/C10H11ClN2O/c1-2-6-12-10(14)13-9-5-3-4-8(11)7-9/h2-5,7H,1,6H2,(H2,12,13,14) |
| InChIKey | ITFLIVVAIKVBLP-UHFFFAOYSA-N |
| Mol Weight | 210.66 g/mol |
| Molecular Formula | C10H11ClN2O |
| Exact Mass | 210.055991 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | BoFjpmICgSx |
|---|---|
| Name | 1-Allyl-3-(m-chlorophenyl)urea |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 210.055990681 u |
| Formula | C10H11ClN2O |
| InChI | InChI=1S/C10H11ClN2O/c1-2-6-12-10(14)13-9-5-3-4-8(11)7-9/h2-5,7H,1,6H2,(H2,12,13,14) |
| InChIKey | ITFLIVVAIKVBLP-UHFFFAOYSA-N |
| SMILES | N(C1=CC=CC(=C1)Cl)C(NCC=C)=O |
| Spectrum/Structure Validation Score (Raman) | 0.944146 |