| SpectraBase Compound ID | EZA1LMaMb4m |
|---|---|
| InChI | InChI=1S/C15H11ClO3/c16-14(17)10-19-13-8-6-12(7-9-13)15(18)11-4-2-1-3-5-11/h1-9H,10H2 |
| InChIKey | OFFPGBCXVZIFPG-UHFFFAOYSA-N |
| Mol Weight | 274.7 g/mol |
| Molecular Formula | C15H11ClO3 |
| Exact Mass | 274.039672 g/mol |
| SpectraBase Spectrum ID | 1FyBdZksprq |
|---|---|
| Name | 1-[(Chlorocarbonyl)methoxy]-4-benzoylbenzene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.039671911 u |
| Formula | C15H11ClO3 |
| InChI | InChI=1S/C15H11ClO3/c16-14(17)10-19-13-8-6-12(7-9-13)15(18)11-4-2-1-3-5-11/h1-9H,10H2 |
| InChIKey | OFFPGBCXVZIFPG-UHFFFAOYSA-N |
| SMILES | C(C1=CC=C(OCC(=O)Cl)C=C1)(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.976356 |