| SpectraBase Compound ID | 2ioNDDw30VL |
|---|---|
| InChI | InChI=1S/C12H23NO4/c1-9(2)7-16-11(14)6-13(5)12(15)17-8-10(3)4/h9-10H,6-8H2,1-5H3 |
| InChIKey | HDZHPJOCIDYSCN-UHFFFAOYSA-N |
| Mol Weight | 245.32 g/mol |
| Molecular Formula | C12H23NO4 |
| Exact Mass | 245.162708 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7MQDJ9cARKV |
|---|---|
| Name | Glycine, N-methyl-N-isobutoxycarbonyl-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 245.162708221 u |
| Formula | C12H23NO4 |
| InChI | InChI=1S/C12H23NO4/c1-9(2)7-16-11(14)6-13(5)12(15)17-8-10(3)4/h9-10H,6-8H2,1-5H3 |
| InChIKey | HDZHPJOCIDYSCN-UHFFFAOYSA-N |
| Molecular Weight | 245.319 g/mol |
| SMILES | CC(COC(N(C)CC(OCC(C)C)=O)=O)C |