![4-[1-(4-Chlorophenyl)ethyl]-1,2-dimethyl-benzene](/api/spectrum/2xpsFNLkyIk/structure.png?h=300&w=458 "4-[1-(4-Chlorophenyl)ethyl]-1,2-dimethyl-benzene")
| SpectraBase Compound ID | KV10b3kDVSM |
|---|---|
| InChI | InChI=1S/C16H17Cl/c1-11-4-5-15(10-12(11)2)13(3)14-6-8-16(17)9-7-14/h4-10,13H,1-3H3 |
| InChIKey | IXKGQEVZDWFOBM-UHFFFAOYSA-N |
| Mol Weight | 244.76 g/mol |
| Molecular Formula | C16H17Cl |
| Exact Mass | 244.101878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2xpsFNLkyIk |
|---|---|
| Name | 4-[1-(4-Chlorophenyl)ethyl]-1,2-dimethyl-benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 244.101878247 u |
| Formula | C16H17Cl |
| InChI | InChI=1S/C16H17Cl/c1-11-4-5-15(10-12(11)2)13(3)14-6-8-16(17)9-7-14/h4-10,13H,1-3H3 |
| InChIKey | IXKGQEVZDWFOBM-UHFFFAOYSA-N |
| Molecular Weight | 244.765 g/mol |
| SMILES | C(C)(C=1C=CC(=CC1)Cl)C=1C=C(C(=CC1)C)C |