| SpectraBase Compound ID | L1xtrFXpscm |
|---|---|
| InChI | InChI=1S/C14H21NO3S/c1-3-4-5-6-9-18-14(17)11(2)15-13(16)12-8-7-10-19-12/h7-8,10-11H,3-6,9H2,1-2H3,(H,15,16) |
| InChIKey | RLNPLNZAYHBVMC-UHFFFAOYSA-N |
| Mol Weight | 283.39 g/mol |
| Molecular Formula | C14H21NO3S |
| Exact Mass | 283.124215 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 43qVehF06fV |
|---|---|
| Name | L-Alanine, N-(2-thienylcarbonyl)-, hexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 283.124214711 u |
| Formula | C14H21NO3S |
| InChI | InChI=1S/C14H21NO3S/c1-3-4-5-6-9-18-14(17)11(2)15-13(16)12-8-7-10-19-12/h7-8,10-11H,3-6,9H2,1-2H3,(H,15,16) |
| InChIKey | RLNPLNZAYHBVMC-UHFFFAOYSA-N |
| SMILES | CCCCCCOC(C(NC(C=1SC=CC1)=O)C)=O |