| SpectraBase Compound ID | 1Y5o54Yb8fb |
|---|---|
| InChI | InChI=1S/C13H21NO5/c1-5-18-11(16)10-8-9(15)6-7-14(10)12(17)19-13(2,3)4/h10H,5-8H2,1-4H3/t10-/m0/s1 |
| InChIKey | YAVQLRUBKDCOCI-JTQLQIEISA-N |
| Mol Weight | 271.31 g/mol |
| Molecular Formula | C13H21NO5 |
| Exact Mass | 271.141973 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | K0pTwDkccB2 |
|---|---|
| Name | (2S)-4-Ketopiperidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-ethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.141972775 u |
| Formula | C13H21NO5 |
| InChI | InChI=1S/C13H21NO5/c1-5-18-11(16)10-8-9(15)6-7-14(10)12(17)19-13(2,3)4/h10H,5-8H2,1-4H3/t10-/m0/s1 |
| InChIKey | YAVQLRUBKDCOCI-JTQLQIEISA-N |
| SMILES | C(N1[C@](C(=O)OCC)(CC(CC1)=O)[H])(OC(C)(C)C)=O |