![2-[(4-Chlorophenyl)methyl]-1,4-dimethylbenzene](/api/spectrum/I1DRfyawICl/structure.png?h=300&w=458 "2-[(4-Chlorophenyl)methyl]-1,4-dimethylbenzene")
| SpectraBase Compound ID | AILMgOE7JqP |
|---|---|
| InChI | InChI=1S/C15H15Cl/c1-11-3-4-12(2)14(9-11)10-13-5-7-15(16)8-6-13/h3-9H,10H2,1-2H3 |
| InChIKey | NECXOIBOEYNQFJ-UHFFFAOYSA-N |
| Mol Weight | 230.74 g/mol |
| Molecular Formula | C15H15Cl |
| Exact Mass | 230.086228 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I1DRfyawICl |
|---|---|
| Name | 2-[(4-Chlorophenyl)methyl]-1,4-dimethylbenzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.086228183 u |
| Formula | C15H15Cl |
| InChI | InChI=1S/C15H15Cl/c1-11-3-4-12(2)14(9-11)10-13-5-7-15(16)8-6-13/h3-9H,10H2,1-2H3 |
| InChIKey | NECXOIBOEYNQFJ-UHFFFAOYSA-N |
| Molecular Weight | 230.738 g/mol |
| SMILES | C=1(C(=CC=C(C1)C)C)CC1=CC=C(C=C1)Cl |