| SpectraBase Compound ID | jfMOE00NB6 |
|---|---|
| InChI | InChI=1S/C16H17Cl/c1-13-2-4-14(5-3-13)6-7-15-8-10-16(12-17)11-9-15/h2-5,8-11H,6-7,12H2,1H3 |
| InChIKey | KPMLKMFJUOBFBC-UHFFFAOYSA-N |
| Mol Weight | 244.76 g/mol |
| Molecular Formula | C16H17Cl |
| Exact Mass | 244.101878 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 4fYggSX4ayt |
|---|---|
| Name | 1-(4-Chloromethylphenyl)-2-(4-methylphenyl)ethane |
| 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/c1-13-2-4-14(5-3-13)6-7-15-8-10-16(12-17)11-9-15/h2-5,8-11H,6-7,12H2,1H3 |
| InChIKey | KPMLKMFJUOBFBC-UHFFFAOYSA-N |
| Molecular Weight | 244.765 g/mol |
| SMILES | C=1(CCC=2C=CC(=CC2)CCl)C=CC(=CC1)C |