| SpectraBase Compound ID | FCDAB1lrmbJ |
|---|---|
| InChI | InChI=1S/C11H18/c1-3-10(2)9-11-7-5-4-6-8-11/h3-8H2,1-2H3 |
| InChIKey | GVJNIIBGXYZJSC-UHFFFAOYSA-N |
| Mol Weight | 150.26 g/mol |
| Molecular Formula | C11H18 |
| Exact Mass | 150.140851 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3X6GI8ByAtv |
|---|---|
| Name | 3-Methyl-1,1-pentamethylene-1,2-pentadiene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 150.140850580 u |
| Formula | C11H18 |
| InChI | InChI=1S/C11H18/c1-3-10(2)9-11-7-5-4-6-8-11/h3-8H2,1-2H3 |
| InChIKey | GVJNIIBGXYZJSC-UHFFFAOYSA-N |
| Molecular Weight | 150.265 g/mol |
| SMILES | C1(=C=C(CC)C)CCCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.824111 |