| SpectraBase Compound ID | FjNbmGYqLGi |
|---|---|
| InChI | InChI=1S/C11H17NO5/c1-11(2,3)17-9(14)7-5-6-8(13)12(7)10(15)16-4/h7H,5-6H2,1-4H3/t7-/m0/s1 |
| InChIKey | VDQCCEIXZWIDFJ-ZETCQYMHSA-N |
| Mol Weight | 243.26 g/mol |
| Molecular Formula | C11H17NO5 |
| Exact Mass | 243.110673 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ao0KNTflQOA |
|---|---|
| Name | (2S)-5-Ketopyrrolidine-1,2-dicarboxylic acid O2-tert-butyl ester O1-methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 243.110672646 u |
| Formula | C11H17NO5 |
| InChI | InChI=1S/C11H17NO5/c1-11(2,3)17-9(14)7-5-6-8(13)12(7)10(15)16-4/h7H,5-6H2,1-4H3/t7-/m0/s1 |
| InChIKey | VDQCCEIXZWIDFJ-ZETCQYMHSA-N |
| Molecular Weight | 243.259 g/mol |
| SMILES | [C@]1(N(C(CC1)=O)C(=O)OC)(C(OC(C)(C)C)=O)[H] |