| SpectraBase Compound ID | Gila2pJTANe |
|---|---|
| InChI | InChI=1S/C12H24/c1-4-6-7-8-9-11-12(3)10-5-2/h6-7,12H,4-5,8-11H2,1-3H3/b7-6+ |
| InChIKey | OZAKSOOHNYFFDJ-VOTSOKGWSA-N |
| Mol Weight | 168.32 g/mol |
| Molecular Formula | C12H24 |
| Exact Mass | 168.187801 g/mol |
| SpectraBase Spectrum ID | LIxRe88SM42 |
|---|---|
| Name | 3-Undecene, 8-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.187800773 u |
| Formula | C12H24 |
| InChI | InChI=1S/C12H24/c1-4-6-7-8-9-11-12(3)10-5-2/h6-7,12H,4-5,8-11H2,1-3H3/b7-6+ |
| InChIKey | OZAKSOOHNYFFDJ-VOTSOKGWSA-N |
| Molecular Weight | 168.324 g/mol |
| SMILES | CCCC(C)CCC\C=C\CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.962191 |