| SpectraBase Compound ID | CHnF05GlMOh |
|---|---|
| InChI | InChI=1S/C14H22/c1-5-11(3)13-8-7-9-14(10-13)12(4)6-2/h7-12H,5-6H2,1-4H3 |
| InChIKey | SGJNVYYELDBNLA-UHFFFAOYSA-N |
| Mol Weight | 190.33 g/mol |
| Molecular Formula | C14H22 |
| Exact Mass | 190.172151 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 | 5iZMPmbIuU6 |
|---|---|
| Name | Benzene, 1,3-bis(1-methylpropyl)- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 190.172150708 u |
| Formula | C14H22 |
| InChI | InChI=1S/C14H22/c1-5-11(3)13-8-7-9-14(10-13)12(4)6-2/h7-12H,5-6H2,1-4H3 |
| InChIKey | SGJNVYYELDBNLA-UHFFFAOYSA-N |
| Molecular Weight | 190.330 g/mol |
| SMILES | C(C(C)C1=CC(C(CC)C)=CC=C1)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.945359 |