| SpectraBase Compound ID | 49lI9IIfJ6k |
|---|---|
| InChI | InChI=1S/C14H27NO4S/c1-5-18-14(17)15-12(8-10-20-4)13(16)19-9-6-7-11(2)3/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | UHOBKQYCTLPWFY-UHFFFAOYSA-N |
| Mol Weight | 305.43 g/mol |
| Molecular Formula | C14H27NO4S |
| Exact Mass | 305.16608 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | cliOuvo4nd |
|---|---|
| Name | L-Methionine, N-ethoxycarbonyl-, isohexyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 305.166079523 u |
| Formula | C14H27NO4S |
| InChI | InChI=1S/C14H27NO4S/c1-5-18-14(17)15-12(8-10-20-4)13(16)19-9-6-7-11(2)3/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | UHOBKQYCTLPWFY-UHFFFAOYSA-N |
| Molecular Weight | 305.433 g/mol |
| SMILES | CCOC(NC(C(OCCCC(C)C)=O)CCSC)=O |