| SpectraBase Compound ID | Ggwe56FvGuk |
|---|---|
| InChI | InChI=1S/C20H34/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-17-15-19(2)16-18-20/h15-18H,3-14H2,1-2H3 |
| InChIKey | KKRPGHAVXTZBDL-UHFFFAOYSA-N |
| Mol Weight | 274.5 g/mol |
| Molecular Formula | C20H34 |
| Exact Mass | 274.266051 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | EewmW2Oq3ro |
|---|---|
| Name | Benzene, 1-methyl-4-tridecyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 274.266051095 u |
| Formula | C20H34 |
| InChI | InChI=1S/C20H34/c1-3-4-5-6-7-8-9-10-11-12-13-14-20-17-15-19(2)16-18-20/h15-18H,3-14H2,1-2H3 |
| InChIKey | KKRPGHAVXTZBDL-UHFFFAOYSA-N |
| Molecular Weight | 274.492 g/mol |
| SMILES | C(CCCCCCCCCCc1ccc(cc1)C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.81188 |