| SpectraBase Compound ID | EM4udOwOYU8 |
|---|---|
| InChI | InChI=1S/C6H11NO4/c7-4(3-6(10)11)1-2-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11) |
| InChIKey | XABCFXXGZPWJQP-UHFFFAOYSA-N |
| Mol Weight | 161.16 g/mol |
| Molecular Formula | C6H11NO4 |
| Exact Mass | 161.068808 g/mol |
Raman Spectrum
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JmHHKLXesFb |
|---|---|
| Name | 3-Aminoadipic acid |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 161.068807834 u |
| Formula | C6H11NO4 |
| InChI | InChI=1S/C6H11NO4/c7-4(3-6(10)11)1-2-5(8)9/h4H,1-3,7H2,(H,8,9)(H,10,11) |
| InChIKey | XABCFXXGZPWJQP-UHFFFAOYSA-N |
| Molecular Weight | 161.157 g/mol |
| SMILES | C(CC(N)CCC(=O)O)(=O)O |
| Spectrum/Structure Validation Score (Raman) | 0.892257 |