| SpectraBase Compound ID | GCs8Cfq9JSa |
|---|---|
| InChI | InChI=1S/C11H12/c1-3-4-8-11-9-6-5-7-10(11)2/h4-7,9H,1,8H2,2H3 |
| InChIKey | DZJQUZIWIPSLMP-UHFFFAOYSA-N |
| Mol Weight | 144.22 g/mol |
| Molecular Formula | C11H12 |
| Exact Mass | 144.0939 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4XuTE4gOoHq |
|---|---|
| Name | Benzene, 1-(2,3-butadienyl)-2-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 144.093900386 u |
| Formula | C11H12 |
| InChI | InChI=1S/C11H12/c1-3-4-8-11-9-6-5-7-10(11)2/h4-7,9H,1,8H2,2H3 |
| InChIKey | DZJQUZIWIPSLMP-UHFFFAOYSA-N |
| Molecular Weight | 144.217 g/mol |
| SMILES | C(=C=C)CC=1C(C)=CC=CC1 |