| SpectraBase Compound ID | 1qv1qIyvV0j |
|---|---|
| InChI | InChI=1S/C14H28O/c1-5-7-9-13(11-12(3)4)14(15)10-8-6-2/h11,13-15H,5-10H2,1-4H3 |
| InChIKey | PEZWEBQCOFZMGQ-UHFFFAOYSA-N |
| Mol Weight | 212.38 g/mol |
| Molecular Formula | C14H28O |
| Exact Mass | 212.214016 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 5wor0b2XLDV |
|---|---|
| Name | 4-Butyl-2-methyl-2-nonen-5-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 212.214015521 u |
| Formula | C14H28O |
| InChI | InChI=1S/C14H28O/c1-5-7-9-13(11-12(3)4)14(15)10-8-6-2/h11,13-15H,5-10H2,1-4H3 |
| InChIKey | PEZWEBQCOFZMGQ-UHFFFAOYSA-N |
| Molecular Weight | 212.377 g/mol |
| SMILES | CC(=CC(C(CCCC)O)CCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.872529 |