| SpectraBase Compound ID | 1pin4shqwAs |
|---|---|
| InChI | InChI=1S/C11H20ClNO4S/c1-3-6-16-10(14)9(4-8-18-2)13-11(15)17-7-5-12/h9H,3-8H2,1-2H3,(H,13,15) |
| InChIKey | KBJSKBXNGBSLFJ-UHFFFAOYSA-N |
| Mol Weight | 297.8 g/mol |
| Molecular Formula | C11H20ClNO4S |
| Exact Mass | 297.080157 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 2IrEkkeDxUO |
|---|---|
| Name | L-Methionine, N-(2-chloroethoxycarbonyl)-, propyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 297.080156998 u |
| Formula | C11H20ClNO4S |
| InChI | InChI=1S/C11H20ClNO4S/c1-3-6-16-10(14)9(4-8-18-2)13-11(15)17-7-5-12/h9H,3-8H2,1-2H3,(H,13,15) |
| InChIKey | KBJSKBXNGBSLFJ-UHFFFAOYSA-N |
| SMILES | CSCCC(C(OCCC)=O)NC(OCCCl)=O |