![Isoxazole, 4,5-dihydro-5-[(4-methoxyphenyl)methyl]-](/api/spectrum/3XGpQnkCBGe/structure.png?h=300&w=458 "Isoxazole, 4,5-dihydro-5-[(4-methoxyphenyl)methyl]-")
| SpectraBase Compound ID | CYLwIPKv7JY |
|---|---|
| InChI | InChI=1S/C11H13NO2/c1-13-10-4-2-9(3-5-10)8-11-6-7-12-14-11/h2-5,7,11H,6,8H2,1H3 |
| InChIKey | UMLNHAGGSMPFAS-UHFFFAOYSA-N |
| Mol Weight | 191.23 g/mol |
| Molecular Formula | C11H13NO2 |
| Exact Mass | 191.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 3XGpQnkCBGe |
|---|---|
| Name | Isoxazole, 4,5-dihydro-5-[(4-methoxyphenyl)methyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 191.094628661 u |
| Formula | C11H13NO2 |
| InChI | InChI=1S/C11H13NO2/c1-13-10-4-2-9(3-5-10)8-11-6-7-12-14-11/h2-5,7,11H,6,8H2,1H3 |
| InChIKey | UMLNHAGGSMPFAS-UHFFFAOYSA-N |
| Molecular Weight | 191.230 g/mol |
| SMILES | C=1CC(CC2=CC=C(OC)C=C2)ON1 |