| SpectraBase Compound ID | FBwtNtPoAn0 |
|---|---|
| InChI | InChI=1S/C22H41NO3/c1-3-5-7-8-9-10-11-12-13-14-19-26-22(25)20-16-15-18-23(20)21(24)17-6-4-2/h20H,3-19H2,1-2H3 |
| InChIKey | XZTTWSXRUPIKBG-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 | 48sYFOhS1TK |
|---|---|
| Name | L-Proline, N-valeryl-, 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/c1-3-5-7-8-9-10-11-12-13-14-19-26-22(25)20-16-15-18-23(20)21(24)17-6-4-2/h20H,3-19H2,1-2H3 |
| InChIKey | XZTTWSXRUPIKBG-UHFFFAOYSA-N |
| Molecular Weight | 367.574 g/mol |
| SMILES | C(C1CCCN1C(=O)CCCC)(=O)OCCCCCCCCCCCC |