| SpectraBase Compound ID | CBw41DbtEyc |
|---|---|
| InChI | InChI=1S/C14H27NO4S/c1-5-6-8-18-13(16)12(7-9-20-4)15-14(17)19-10-11(2)3/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | WHQAVGPSKUGRHO-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 | 2paoIyXZSNb |
|---|---|
| Name | L-Methionine, N-isobutoxycarbonyl-, butyl 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/c1-5-6-8-18-13(16)12(7-9-20-4)15-14(17)19-10-11(2)3/h11-12H,5-10H2,1-4H3,(H,15,17) |
| InChIKey | WHQAVGPSKUGRHO-UHFFFAOYSA-N |
| Molecular Weight | 305.433 g/mol |
| SMILES | CC(C)COC(NC(C(OCCCC)=O)CCSC)=O |