| SpectraBase Compound ID | AyNFHNgs5WA |
|---|---|
| InChI | InChI=1S/C12H18/c1-9(2)11-7-5-6-8-12(11)10(3)4/h5-10H,1-4H3 |
| InChIKey | OKIRBHVFJGXOIS-UHFFFAOYSA-N |
| Mol Weight | 162.28 g/mol |
| Molecular Formula | C12H18 |
| Exact Mass | 162.140851 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Gll2RHWJG7z |
|---|---|
| Name | Benzene, 1,2-bis(1-methylethyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.140850580 u |
| Formula | C12H18 |
| InChI | InChI=1S/C12H18/c1-9(2)11-7-5-6-8-12(11)10(3)4/h5-10H,1-4H3 |
| InChIKey | OKIRBHVFJGXOIS-UHFFFAOYSA-N |
| Molecular Weight | 162.276 g/mol |
| SMILES | C1=CC=CC(=C1C(C)C)C(C)C |