| SpectraBase Compound ID | Ad77MqqllJt |
|---|---|
| InChI | InChI=1S/C15H11ClO2/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15H,9H2 |
| InChIKey | JTHUHLHYZHHUMR-UHFFFAOYSA-N |
| Mol Weight | 258.7 g/mol |
| Molecular Formula | C15H11ClO2 |
| Exact Mass | 258.044757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5aY36CieMqM |
|---|---|
| Name | 6-Chloro-2-phenylchroman-4-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 258.044757292 u |
| Formula | C15H11ClO2 |
| InChI | InChI=1S/C15H11ClO2/c16-11-6-7-14-12(8-11)13(17)9-15(18-14)10-4-2-1-3-5-10/h1-8,15H,9H2 |
| InChIKey | JTHUHLHYZHHUMR-UHFFFAOYSA-N |
| Molecular Weight | 258.704 g/mol |
| SMILES | C=12C(CC(OC2=CC=C(C1)Cl)C=1C=CC=CC1)=O |