| SpectraBase Compound ID | CVK0g5PS0B0 |
|---|---|
| InChI | InChI=1S/C12H16/c1-4-5-6-12-8-7-10(2)11(3)9-12/h4-5,7-9H,6H2,1-3H3/b5-4+ |
| InChIKey | PKDQZBULDXKDSQ-SNAWJCMRSA-N |
| Mol Weight | 160.26 g/mol |
| Molecular Formula | C12H16 |
| Exact Mass | 160.125201 g/mol |
Vapor Phase (Gas) Infrared Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8G7Yr5bWRXl |
|---|---|
| Name | Benzene, 4-(2-butenyl)-1,2-dimethyl-, (E)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 160.125200515 u |
| Formula | C12H16 |
| InChI | InChI=1S/C12H16/c1-4-5-6-12-8-7-10(2)11(3)9-12/h4-5,7-9H,6H2,1-3H3/b5-4+ |
| InChIKey | PKDQZBULDXKDSQ-SNAWJCMRSA-N |
| Molecular Weight | 160.260 g/mol |
| SMILES | C(\C=C\C)C1=CC(C)=C(C=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962388 |