| SpectraBase Compound ID | GhRIhlQk8wc |
|---|---|
| InChI | InChI=1S/C14H14N2O2/c1-3-9-15-14(17)12-10(2)18-16-13(12)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3,(H,15,17) |
| InChIKey | GHXORLQEYUSGGT-UHFFFAOYSA-N |
| Mol Weight | 242.28 g/mol |
| Molecular Formula | C14H14N2O2 |
| Exact Mass | 242.105528 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CbHQaZFdg5q |
|---|---|
| Name | N-Allyl-5-methyl-3-phenyl-4-isoxazolecarboxamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 242.105527697 u |
| Formula | C14H14N2O2 |
| InChI | InChI=1S/C14H14N2O2/c1-3-9-15-14(17)12-10(2)18-16-13(12)11-7-5-4-6-8-11/h3-8H,1,9H2,2H3,(H,15,17) |
| InChIKey | GHXORLQEYUSGGT-UHFFFAOYSA-N |
| Molecular Weight | 242.278 g/mol |
| SMILES | N(C(C=1C(=NOC1C)C=1C=CC=CC1)=O)CC=C |