| SpectraBase Compound ID | Hre4w9o1d1 |
|---|---|
| InChI | InChI=1S/C14H10ClNO2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(17)18/h1-10H |
| InChIKey | WKGWMIAHCAJHPK-UHFFFAOYSA-N |
| Mol Weight | 259.69 g/mol |
| Molecular Formula | C14H10ClNO2 |
| Exact Mass | 259.040006 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | EpbAoeoI4m2 |
|---|---|
| Name | 4-Chloro-4'-nitrostilbene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 259.040006264 u |
| Formula | C14H10ClNO2 |
| InChI | InChI=1S/C14H10ClNO2/c15-13-7-3-11(4-8-13)1-2-12-5-9-14(10-6-12)16(17)18/h1-10H |
| InChIKey | WKGWMIAHCAJHPK-UHFFFAOYSA-N |
| Molecular Weight | 259.692 g/mol |
| SMILES | N(=O)(=O)C1=CC=C(C=C1)C=CC=1C=CC(=CC1)Cl |
| Spectrum/Structure Validation Score (Raman) | 0.860249 |