| SpectraBase Compound ID | Fftt2dVjQCu |
|---|---|
| InChI | InChI=1S/C13H17NO3/c1-14(16)12(9-6-10-13(15)17-2)11-7-4-3-5-8-11/h3-8,10,12,16H,9H2,1-2H3/b10-6+ |
| InChIKey | IIWUMDMVNYTCOC-UXBLZVDNSA-N |
| Mol Weight | 235.28 g/mol |
| Molecular Formula | C13H17NO3 |
| Exact Mass | 235.120843 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8XprKoiJMqT |
|---|---|
| Name | Methyl 5-phenyl-5-(N-methyl-N-hydroxy)aminopent-2-en-1-oate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 235.120843408 u |
| Formula | C13H17NO3 |
| InChI | InChI=1S/C13H17NO3/c1-14(16)12(9-6-10-13(15)17-2)11-7-4-3-5-8-11/h3-8,10,12,16H,9H2,1-2H3/b10-6+ |
| InChIKey | IIWUMDMVNYTCOC-UXBLZVDNSA-N |
| Molecular Weight | 235.283 g/mol |
| SMILES | C(\C=C\CC(N(O)C)C1=CC=CC=C1)(=O)OC |