| SpectraBase Compound ID | 57rHdw21Chq |
|---|---|
| InChI | InChI=1S/C15H26O2/c1-3-5-7-8-9-10-11-12-13-15(16)17-14-6-4-2/h1H,4-14H2,2H3 |
| InChIKey | GDIRFVXFPCQNDO-UHFFFAOYSA-N |
| Mol Weight | 238.37 g/mol |
| Molecular Formula | C15H26O2 |
| Exact Mass | 238.19328 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | ARR3mQqtdwy |
|---|---|
| Name | Undec-10-ynoic acid, butyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 238.193280075 u |
| Formula | C15H26O2 |
| InChI | InChI=1S/C15H26O2/c1-3-5-7-8-9-10-11-12-13-15(16)17-14-6-4-2/h1H,4-14H2,2H3 |
| InChIKey | GDIRFVXFPCQNDO-UHFFFAOYSA-N |
| Molecular Weight | 238.371 g/mol |
| SMILES | C(CCCC(OCCCC)=O)CCCCC#C |