| SpectraBase Compound ID | KA4G9TGSObd |
|---|---|
| InChI | InChI=1S/C14H19NO3/c1-10(2)9-18-14(17)13(16)15-8-12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3,(H,15,16) |
| InChIKey | RGDGSIXORSSPPL-UHFFFAOYSA-N |
| Mol Weight | 249.31 g/mol |
| Molecular Formula | C14H19NO3 |
| Exact Mass | 249.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BskkPrxu2ik |
|---|---|
| Name | Oxalic acid, monoamide, N-(4-methylbenzyl)-, isobutyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 249.136493473 u |
| Formula | C14H19NO3 |
| InChI | InChI=1S/C14H19NO3/c1-10(2)9-18-14(17)13(16)15-8-12-6-4-11(3)5-7-12/h4-7,10H,8-9H2,1-3H3,(H,15,16) |
| InChIKey | RGDGSIXORSSPPL-UHFFFAOYSA-N |
| Molecular Weight | 249.310 g/mol |
| SMILES | C(NC(C(=O)OCC(C)C)=O)C1=CC=C(C=C1)C |