| SpectraBase Spectrum ID |
FGxeZoWGZMd |
| Name |
(2S)-2-Acetyl-1-piperidinecarboxylic acid tert-butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
227.152143537 u |
| Formula |
C12H21NO3 |
| InChI |
InChI=1S/C12H21NO3/c1-9(14)10-7-5-6-8-13(10)11(15)16-12(2,3)4/h10H,5-8H2,1-4H3/t10-/m0/s1 |
| InChIKey |
CKHYGWMWQKVMQE-JTQLQIEISA-N |
| Molecular Weight |
227.304 g/mol |
| SMILES |
C(N1[C@](C(=O)C)(CCCC1)[H])(OC(C)(C)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867926 |
