| SpectraBase Compound ID | LLdUxiKnNWs |
|---|---|
| InChI | InChI=1S/C13H13NO2/c1-3-9-13(2)12(15)16-11(14-13)10-7-5-4-6-8-10/h3-8H,1,9H2,2H3 |
| InChIKey | CBNLHBSJMRSUKJ-UHFFFAOYSA-N |
| Mol Weight | 215.25 g/mol |
| Molecular Formula | C13H13NO2 |
| Exact Mass | 215.094629 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Ee940U6899c |
|---|---|
| Name | 4-Allyl-4-methyl-2-phenyl-2-oxazolin-5-one |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 215.094628661 u |
| Formula | C13H13NO2 |
| InChI | InChI=1S/C13H13NO2/c1-3-9-13(2)12(15)16-11(14-13)10-7-5-4-6-8-10/h3-8H,1,9H2,2H3 |
| InChIKey | CBNLHBSJMRSUKJ-UHFFFAOYSA-N |
| Molecular Weight | 215.252 g/mol |
| SMILES | C1(=NC(C(O1)=O)(CC=C)C)C=1C=CC=CC1 |