| SpectraBase Compound ID | 4fbdkZMugAz |
|---|---|
| InChI | InChI=1S/C13H16/c1-9-4-7-13(10(2)8-9)11(3)12-5-6-12/h4,7-8,12H,3,5-6H2,1-2H3 |
| InChIKey | FSFZXVCIZPAREZ-UHFFFAOYSA-N |
| Mol Weight | 172.27 g/mol |
| Molecular Formula | C13H16 |
| Exact Mass | 172.125201 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | GrKzKCUIuF6 |
|---|---|
| Name | alpha-Cyclopropyl-2,4-dimethylstyrene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.125200515 u |
| Formula | C13H16 |
| InChI | InChI=1S/C13H16/c1-9-4-7-13(10(2)8-9)11(3)12-5-6-12/h4,7-8,12H,3,5-6H2,1-2H3 |
| InChIKey | FSFZXVCIZPAREZ-UHFFFAOYSA-N |
| SMILES | C=C(C1CC1)C=1C=CC(=CC1C)C |
| Spectrum/Structure Validation Score (Raman) | 0.757304 |