| SpectraBase Compound ID | 5G4WcNDYP2P |
|---|---|
| InChI | InChI=1S/C13H16N2O4/c14-13(18)11(15-9-16)6-7-12(17)19-8-10-4-2-1-3-5-10/h1-5,9,11H,6-8H2,(H2,14,18)(H,15,16) |
| InChIKey | LJIZLVVLEYQXEW-UHFFFAOYSA-N |
| Mol Weight | 264.28 g/mol |
| Molecular Formula | C13H16N2O4 |
| Exact Mass | 264.111007 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3TvHg4JU5Xz |
|---|---|
| Name | N-Formyl-o-benzylisoglutamine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 264.111006999 u |
| Formula | C13H16N2O4 |
| InChI | InChI=1S/C13H16N2O4/c14-13(18)11(15-9-16)6-7-12(17)19-8-10-4-2-1-3-5-10/h1-5,9,11H,6-8H2,(H2,14,18)(H,15,16) |
| InChIKey | LJIZLVVLEYQXEW-UHFFFAOYSA-N |
| Molecular Weight | 264.281 g/mol |
| SMILES | C1=CC=C(C=C1)COC(CCC(C(N)=O)NC=O)=O |