| SpectraBase Compound ID | EYBsvgvF5SK |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-4-6-8-9(7-5-2)10(11)12-3/h5H,4,6,8H2,1-3H3 |
| InChIKey | NINGSWZYDYXXOV-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ErkcKGjGX6L |
|---|---|
| Name | Methyl-2-butyl-2,3-pentadienoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-4-6-8-9(7-5-2)10(11)12-3/h5H,4,6,8H2,1-3H3 |
| InChIKey | NINGSWZYDYXXOV-UHFFFAOYSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C(=O)(C(=C=CC)CCCC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.835911 |