| SpectraBase Compound ID | y1W1p3WXVi |
|---|---|
| InChI | InChI=1S/C20H31NO3S/c1-2-3-4-5-6-7-8-9-15-24-20(23)17-12-10-14-21(17)19(22)18-13-11-16-25-18/h11,13,16-17H,2-10,12,14-15H2,1H3 |
| InChIKey | MRAHQKHFWMTGBR-UHFFFAOYSA-N |
| Mol Weight | 365.53 g/mol |
| Molecular Formula | C20H31NO3S |
| Exact Mass | 365.202465 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BtPYwVDqMBn |
|---|---|
| Name | L-Proline, N-(thiophen-2-carbonyl)-, decyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 365.202465033 u |
| Formula | C20H31NO3S |
| InChI | InChI=1S/C20H31NO3S/c1-2-3-4-5-6-7-8-9-15-24-20(23)17-12-10-14-21(17)19(22)18-13-11-16-25-18/h11,13,16-17H,2-10,12,14-15H2,1H3 |
| InChIKey | MRAHQKHFWMTGBR-UHFFFAOYSA-N |
| Molecular Weight | 365.532 g/mol |
| SMILES | CCCCCCCCCCOC(C1N(C(C=2SC=CC2)=O)CCC1)=O |