| SpectraBase Compound ID | 6UB56GxegCh |
|---|---|
| InChI | InChI=1S/C12H16/c1-4-12(3,5-2)11-9-7-6-8-10-11/h4,6-10H,1,5H2,2-3H3 |
| InChIKey | QPPYVAQQHDNLIM-UHFFFAOYSA-N |
| Mol Weight | 160.26 g/mol |
| Molecular Formula | C12H16 |
| Exact Mass | 160.125201 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GjziZ0svKIa |
|---|---|
| Name | Benzene, (1-ethyl-1-methyl-2-propenyl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.125200515 u |
| Formula | C12H16 |
| InChI | InChI=1S/C12H16/c1-4-12(3,5-2)11-9-7-6-8-10-11/h4,6-10H,1,5H2,2-3H3 |
| InChIKey | QPPYVAQQHDNLIM-UHFFFAOYSA-N |
| Molecular Weight | 160.260 g/mol |
| SMILES | C(C=C)(C1=CC=CC=C1)(CC)C |