| SpectraBase Compound ID | 6G28cFa2exk |
|---|---|
| InChI | InChI=1S/C12H18/c1-3-5-11-7-9-12(6-4-2)10-8-11/h7-10H,3-6H2,1-2H3 |
| InChIKey | PHUANMGFAOCUOQ-UHFFFAOYSA-N |
| Mol Weight | 162.28 g/mol |
| Molecular Formula | C12H18 |
| Exact Mass | 162.140851 g/mol |
Vapor Phase (Gas) Infrared Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 3bdZk07m4bP |
|---|---|
| Name | Benzene, 1,4-dipropyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 162.140850580 u |
| Formula | C12H18 |
| InChI | InChI=1S/C12H18/c1-3-5-11-7-9-12(6-4-2)10-8-11/h7-10H,3-6H2,1-2H3 |
| InChIKey | PHUANMGFAOCUOQ-UHFFFAOYSA-N |
| Molecular Weight | 162.276 g/mol |
| SMILES | C(CC1=CC=C(C=C1)CCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.95258 |