| SpectraBase Compound ID | ChuBMGzPLFq |
|---|---|
| InChI | InChI=1S/C7H14N2O3/c8-6(7(11)12)3-1-2-4-9-5-10/h5-6H,1-4,8H2,(H,9,10)(H,11,12)/t6-/m0/s1 |
| InChIKey | KLPJXDPPMSJWKI-LURJTMIESA-N |
| Mol Weight | 174.2 g/mol |
| Molecular Formula | C7H14N2O3 |
| Exact Mass | 174.100442 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9pfmrSPUMZd |
|---|---|
| Name | N6-Formyl-L-lysine |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 174.100442316 u |
| Formula | C7H14N2O3 |
| InChI | InChI=1S/C7H14N2O3/c8-6(7(11)12)3-1-2-4-9-5-10/h5-6H,1-4,8H2,(H,9,10)(H,11,12)/t6-/m0/s1 |
| InChIKey | KLPJXDPPMSJWKI-LURJTMIESA-N |
| SMILES | OC([C@](CCCCNC=O)(N)[H])=O |
| Spectrum/Structure Validation Score (Raman) | 0.742526 |