| SpectraBase Compound ID | 38nz6LGbsox |
|---|---|
| InChI | InChI=1S/C14H22/c1-3-5-7-10-13(4-2)14-11-8-6-9-12-14/h6,8-9,11-13H,3-5,7,10H2,1-2H3 |
| InChIKey | XEYWPMIXBVMRLE-UHFFFAOYSA-N |
| Mol Weight | 190.33 g/mol |
| Molecular Formula | C14H22 |
| Exact Mass | 190.172151 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2ceGghSw1Tk |
|---|---|
| Name | Benzene, (1-ethylhexyl)- |
| 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/c1-3-5-7-10-13(4-2)14-11-8-6-9-12-14/h6,8-9,11-13H,3-5,7,10H2,1-2H3 |
| InChIKey | XEYWPMIXBVMRLE-UHFFFAOYSA-N |
| Molecular Weight | 190.330 g/mol |
| SMILES | C(C(CC)C1=CC=CC=C1)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974088 |