| SpectraBase Compound ID | KSWdxxMKPsA |
|---|---|
| InChI | InChI=1S/C18H22/c1-12-6-13(2)10-17(9-12)11-18-15(4)7-14(3)8-16(18)5/h6-10H,11H2,1-5H3 |
| InChIKey | LZNZMAZSWVVEBS-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 | 5PzP8EbO4c9 |
|---|---|
| Name | 2-(3,5-Dimethylbenzyl)-1,3,5-trimethylbenzene |
| 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/c1-12-6-13(2)10-17(9-12)11-18-15(4)7-14(3)8-16(18)5/h6-10H,11H2,1-5H3 |
| InChIKey | LZNZMAZSWVVEBS-UHFFFAOYSA-N |
| Molecular Weight | 238.374 g/mol |
| SMILES | C=1(C(=CC(=CC1C)C)C)CC=1C=C(C)C=C(C1)C |