| SpectraBase Compound ID | 3GdT4oxFjQ7 |
|---|---|
| InChI | InChI=1S/C6H14.C6H12/c2*1-3-5-6-4-2/h3-6H2,1-2H3;5-6H,3-4H2,1-2H3 |
| InChIKey | SOTJKLKSONGRGF-UHFFFAOYSA-N |
| Mol Weight | 170.34 g/mol |
| Molecular Formula | C12H26 |
| Exact Mass | 170.203451 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | IhrUhbT0CF6 |
|---|---|
| Name | Poly(tetramethylene-co-Z,E-butenylene) |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 170.203450837 u |
| Formula | C12H26 |
| InChI | InChI=1S/C6H14.C6H12/c2*1-3-5-6-4-2/h3-6H2,1-2H3;5-6H,3-4H2,1-2H3 |
| InChIKey | SOTJKLKSONGRGF-UHFFFAOYSA-N |
| Molecular Weight | 170.340 g/mol |
| Nominal Mass | 170 u |
| SMILES | C(C)CCCC.C(C)C=CCC |
| Spectrum/Structure Validation Score (Raman) | 0.990638 |