| SpectraBase Compound ID | EBh27msvHSS |
|---|---|
| InChI | InChI=1S/C12H14/c1-9(2)11-8-12(11)10-6-4-3-5-7-10/h3-7,12H,8H2,1-2H3 |
| InChIKey | XYEQZPVKKYAFAO-UHFFFAOYSA-N |
| Mol Weight | 158.24 g/mol |
| Molecular Formula | C12H14 |
| Exact Mass | 158.10955 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D1jCD9xYw5d |
|---|---|
| Name | (2-Isopropylidenecyclopropyl)benzene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 158.109550451 u |
| Formula | C12H14 |
| InChI | InChI=1S/C12H14/c1-9(2)11-8-12(11)10-6-4-3-5-7-10/h3-7,12H,8H2,1-2H3 |
| InChIKey | XYEQZPVKKYAFAO-UHFFFAOYSA-N |
| Molecular Weight | 158.244 g/mol |
| SMILES | CC(C)=C1CC1C1=CC=CC=C1 |