| SpectraBase Compound ID | 5n99gGyjuxg |
|---|---|
| InChI | InChI=1S/C21H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20(2)3/h9-10,20H,4-8,11-19H2,1-3H3/b10-9- |
| InChIKey | ICPQWEIHIRVDTI-KTKRTIGZSA-N |
| Mol Weight | 324.5 g/mol |
| Molecular Formula | C21H40O2 |
| Exact Mass | 324.302831 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | Vj9HWTLuwz |
|---|---|
| Name | I-Propyl 11-octadecenoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 324.302830526 u |
| Formula | C21H40O2 |
| InChI | InChI=1S/C21H40O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22)23-20(2)3/h9-10,20H,4-8,11-19H2,1-3H3/b10-9- |
| InChIKey | ICPQWEIHIRVDTI-KTKRTIGZSA-N |
| Molecular Weight | 324.549 g/mol |
| SMILES | C(C(OC(C)C)=O)CCCCCCCC\C=C/CCCCCC |