| SpectraBase Compound ID | DpGDCw0qU65 |
|---|---|
| InChI | InChI=1S/C22H41NO3/c1-6-7-8-9-10-11-12-13-14-15-16-26-22(25)21(19(4)5)23-20(24)17-18(2)3/h17,19,21H,6-16H2,1-5H3,(H,23,24) |
| InChIKey | CBGUICXNMXZJRC-UHFFFAOYSA-N |
| Mol Weight | 367.6 g/mol |
| Molecular Formula | C22H41NO3 |
| Exact Mass | 367.308644 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HWh3FyEyko6 |
|---|---|
| Name | L-Valine, N-(3-methylbut-2-enoyl)-, dodecyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 367.308644181 u |
| Formula | C22H41NO3 |
| InChI | InChI=1S/C22H41NO3/c1-6-7-8-9-10-11-12-13-14-15-16-26-22(25)21(19(4)5)23-20(24)17-18(2)3/h17,19,21H,6-16H2,1-5H3,(H,23,24) |
| InChIKey | CBGUICXNMXZJRC-UHFFFAOYSA-N |
| Molecular Weight | 367.574 g/mol |
| SMILES | C(C(C)C)(C(=O)OCCCCCCCCCCCC)NC(=O)C=C(C)C |