| SpectraBase Compound ID | 9eTjjncm0Fj |
|---|---|
| InChI | InChI=1S/C17H32O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-17(18)16(3)5-2/h13-14,16H,4-12,15H2,1-3H3/b14-13+ |
| InChIKey | ONCXGBUNWVPFHD-BUHFOSPRSA-N |
| Mol Weight | 268.4 g/mol |
| Molecular Formula | C17H32O2 |
| Exact Mass | 268.24023 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | Am9pB1wb7eI |
|---|---|
| Name | (E)-Dodec-2-en-1-yl 2-methylbutanoate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 268.240230268 u |
| Formula | C17H32O2 |
| InChI | InChI=1S/C17H32O2/c1-4-6-7-8-9-10-11-12-13-14-15-19-17(18)16(3)5-2/h13-14,16H,4-12,15H2,1-3H3/b14-13+ |
| InChIKey | ONCXGBUNWVPFHD-BUHFOSPRSA-N |
| SMILES | CCCCCCCCC\C=C\COC(C(CC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.900486 |