| SpectraBase Compound ID | CB9i6SZzhx9 |
|---|---|
| InChI | InChI=1S/C13H24/c1-7-13(6,12(4)5)10-8-9-11(2)3/h7,9,12H,1,8,10H2,2-6H3 |
| InChIKey | ZVXDLQKKKPEOHK-UHFFFAOYSA-N |
| Mol Weight | 180.33 g/mol |
| Molecular Formula | C13H24 |
| Exact Mass | 180.187801 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 | HZ2IixjDZcB |
|---|---|
| Name | 3-Isopropyl-3,7-dimethylocta-1,6-diene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 180.187800773 u |
| Formula | C13H24 |
| InChI | InChI=1S/C13H24/c1-7-13(6,12(4)5)10-8-9-11(2)3/h7,9,12H,1,8,10H2,2-6H3 |
| InChIKey | ZVXDLQKKKPEOHK-UHFFFAOYSA-N |
| Molecular Weight | 180.335 g/mol |
| SMILES | C(C=C)(C(C)C)(CCC=C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937702 |