| SpectraBase Compound ID | FQ1Uruje8RB |
|---|---|
| InChI | InChI=1S/C16H17NO4/c1-11-6-4-7-12(2)15(11)17(10-14(18)20-3)16(19)13-8-5-9-21-13/h4-9H,10H2,1-3H3 |
| InChIKey | HXVYRFCLERCIGP-UHFFFAOYSA-N |
| Mol Weight | 287.31 g/mol |
| Molecular Formula | C16H17NO4 |
| Exact Mass | 287.115758 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | FbT80Xjr6HN |
|---|---|
| Name | Glycine, N-(2,6-dimethylphenyl)-N-(2-furanylcarbonyl)-, methyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.115758027 u |
| Formula | C16H17NO4 |
| InChI | InChI=1S/C16H17NO4/c1-11-6-4-7-12(2)15(11)17(10-14(18)20-3)16(19)13-8-5-9-21-13/h4-9H,10H2,1-3H3 |
| InChIKey | HXVYRFCLERCIGP-UHFFFAOYSA-N |
| SMILES | C1(=C(C(=CC=C1)C)N(CC(OC)=O)C(=O)C1=CC=CO1)C |