| SpectraBase Compound ID | 9RkyQorabLf |
|---|---|
| InChI | InChI=1S/C10H15NO3/c1-3-6-13-10(12)5-4-9-7-8(2)14-11-9/h7H,3-6H2,1-2H3 |
| InChIKey | SRUPFBHOHQDCQT-UHFFFAOYSA-N |
| Mol Weight | 197.23 g/mol |
| Molecular Formula | C10H15NO3 |
| Exact Mass | 197.105193 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 78t6uQTqvnX |
|---|---|
| Name | Propyl 5-methyl-3-isoxazolepropanoate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 197.105193344 u |
| Formula | C10H15NO3 |
| InChI | InChI=1S/C10H15NO3/c1-3-6-13-10(12)5-4-9-7-8(2)14-11-9/h7H,3-6H2,1-2H3 |
| InChIKey | SRUPFBHOHQDCQT-UHFFFAOYSA-N |
| Molecular Weight | 197.234 g/mol |
| SMILES | C=1(C=C(C)ON1)CCC(=O)OCCC |