| SpectraBase Compound ID | 5hnaiF64zEJ |
|---|---|
| InChI | InChI=1S/C17H34O/c1-3-4-5-6-7-8-9-10-11-12-14-17(2)15-13-16-18/h16-17H,3-15H2,1-2H3 |
| InChIKey | JEMZRJOQPUJOQB-UHFFFAOYSA-N |
| Mol Weight | 254.5 g/mol |
| Molecular Formula | C17H34O |
| Exact Mass | 254.260966 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LBurWtp3Gik |
|---|---|
| Name | 4-Methylhexadecanal |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 254.260965714 u |
| Formula | C17H34O |
| InChI | InChI=1S/C17H34O/c1-3-4-5-6-7-8-9-10-11-12-14-17(2)15-13-16-18/h16-17H,3-15H2,1-2H3 |
| InChIKey | JEMZRJOQPUJOQB-UHFFFAOYSA-N |
| Molecular Weight | 254.458 g/mol |
| SMILES | C(CCC(CCCCCCCCCCCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.88033 |