| SpectraBase Compound ID | HANevzAGem6 |
|---|---|
| InChI | InChI=1S/C13H18/c1-7-13-11(5)9(3)8(2)10(4)12(13)6/h7H,1H2,2-6H3 |
| InChIKey | UFMLLTODLZCTMW-UHFFFAOYSA-N |
| Mol Weight | 174.29 g/mol |
| Molecular Formula | C13H18 |
| Exact Mass | 174.140851 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | G4smjb7EmER |
|---|---|
| Name | 2,3,4,5,6-Pentamethylstyrene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.140850580 u |
| Formula | C13H18 |
| InChI | InChI=1S/C13H18/c1-7-13-11(5)9(3)8(2)10(4)12(13)6/h7H,1H2,2-6H3 |
| InChIKey | UFMLLTODLZCTMW-UHFFFAOYSA-N |
| Molecular Weight | 174.287 g/mol |
| SMILES | C=1(C(=C(C(=C(C1C)C)C)C)C)C=C |
| Spectrum/Structure Validation Score (Raman) | 0.700471 |