| SpectraBase Compound ID | LicCF5VZXX9 |
|---|---|
| InChI | InChI=1S/C18H22/c1-2-3-4-6-9-16-12-14-18(15-13-16)17-10-7-5-8-11-17/h5,7-8,10-15H,2-4,6,9H2,1H3 |
| InChIKey | XRPVQXPWEVJKTN-UHFFFAOYSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C18H22 |
| Exact Mass | 238.172151 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 5TvnV8yhTJr |
|---|---|
| Name | 4-N-Hexylbiphenyl |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.172150708 u |
| Formula | C18H22 |
| InChI | InChI=1S/C18H22/c1-2-3-4-6-9-16-12-14-18(15-13-16)17-10-7-5-8-11-17/h5,7-8,10-15H,2-4,6,9H2,1H3 |
| InChIKey | XRPVQXPWEVJKTN-UHFFFAOYSA-N |
| Molecular Weight | 238.374 g/mol |
| SMILES | C1=C(C=CC(=C1)C=1C=CC=CC1)CCCCCC |