| SpectraBase Compound ID | 7omoMlhcpcA |
|---|---|
| InChI | InChI=1S/C12H17NO4S/c1-17-11(15)9(13-10(14)7-2-3-7)6-18-12(16)8-4-5-8/h7-9H,2-6H2,1H3,(H,13,14) |
| InChIKey | QVPMUBLZMYSMFU-UHFFFAOYSA-N |
| Mol Weight | 271.33 g/mol |
| Molecular Formula | C12H17NO4S |
| Exact Mass | 271.087829 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | tKVWuIxcRu |
|---|---|
| Name | L-Cysteine, N,S-bis(cyclopropylcarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.087829201 u |
| Formula | C12H17NO4S |
| InChI | InChI=1S/C12H17NO4S/c1-17-11(15)9(13-10(14)7-2-3-7)6-18-12(16)8-4-5-8/h7-9H,2-6H2,1H3,(H,13,14) |
| InChIKey | QVPMUBLZMYSMFU-UHFFFAOYSA-N |
| Molecular Weight | 271.331 g/mol |
| SMILES | C1CC1C(SCC(C(OC)=O)NC(C1CC1)=O)=O |