| SpectraBase Compound ID | 4EvI4Rmn6TY |
|---|---|
| InChI | InChI=1S/C13H14N2O4/c1-9-6-12(15-19-9)14-13(16)8-18-11-5-3-4-10(7-11)17-2/h3-7H,8H2,1-2H3,(H,14,15,16) |
| InChIKey | DVKBXPSIEMPWAW-UHFFFAOYSA-N |
| Mol Weight | 262.26 g/mol |
| Molecular Formula | C13H14N2O4 |
| Exact Mass | 262.095357 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4DW5tVwG4L |
|---|---|
| Name | Acetamide, 2-(3-methoxyphenoxy)-N-(5-methylisoxazol-3-yl)- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 262.095356935 u |
| Formula | C13H14N2O4 |
| InChI | InChI=1S/C13H14N2O4/c1-9-6-12(15-19-9)14-13(16)8-18-11-5-3-4-10(7-11)17-2/h3-7H,8H2,1-2H3,(H,14,15,16) |
| InChIKey | DVKBXPSIEMPWAW-UHFFFAOYSA-N |
| SMILES | C1(=NOC(=C1)C)NC(=O)COC1=CC=CC(OC)=C1 |