| SpectraBase Spectrum ID |
H37i1rGTk06 |
| Name |
(2S,6S)-Piperidine-2,6-dicarboxylic acid |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
173.068807834 u |
| Formula |
C7H11NO4 |
| InChI |
InChI=1S/C7H11NO4/c9-6(10)4-2-1-3-5(8-4)7(11)12/h4-5,8H,1-3H2,(H,9,10)(H,11,12)/t4-,5-/m0/s1 |
| InChIKey |
SOOPBZRXJMNXTF-WHFBIAKZSA-N |
| Molecular Weight |
173.168 g/mol |
| SMILES |
[C@]1(N[C@@](CCC1)(C(=O)O)[H])(C(=O)O)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965841 |
