| SpectraBase Compound ID | 5HLYmZVuBgi |
|---|---|
| InChI | InChI=1S/C23H44O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-23(24)22(3)5-2/h5H,4,6-21H2,1-3H3/b22-5+ |
| InChIKey | SBKJWIXXZKMGTM-RREIPUBJSA-N |
| Mol Weight | 352.6 g/mol |
| Molecular Formula | C23H44O2 |
| Exact Mass | 352.334131 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GBLfGKWDzAn |
|---|---|
| Name | (Octadecyl E)-2-methylbut-2-enoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.334130655 u |
| Formula | C23H44O2 |
| InChI | InChI=1S/C23H44O2/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-23(24)22(3)5-2/h5H,4,6-21H2,1-3H3/b22-5+ |
| InChIKey | SBKJWIXXZKMGTM-RREIPUBJSA-N |
| Molecular Weight | 352.603 g/mol |
| SMILES | C(=O)(\C(C)=C\C)OCCCCCCCCCCCCCCCCCC |