![4-Piperidinol, 4-[3-(4-methoxyphenyl)-5-isoxazolyl]-1-methyl-](/api/spectrum/8aZJebOvr9C/structure.png?h=300&w=458 "4-Piperidinol, 4-[3-(4-methoxyphenyl)-5-isoxazolyl]-1-methyl-")
| SpectraBase Compound ID | KBCoSgwo3KD |
|---|---|
| InChI | InChI=1S/C16H20N2O3/c1-18-9-7-16(19,8-10-18)15-11-14(17-21-15)12-3-5-13(20-2)6-4-12/h3-6,11,19H,7-10H2,1-2H3 |
| InChIKey | MLWLWEGDMCSRNJ-UHFFFAOYSA-N |
| Mol Weight | 288.35 g/mol |
| Molecular Formula | C16H20N2O3 |
| Exact Mass | 288.147393 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 8aZJebOvr9C |
|---|---|
| Name | 4-Piperidinol, 4-[3-(4-methoxyphenyl)-5-isoxazolyl]-1-methyl- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 288.147392509 u |
| Formula | C16H20N2O3 |
| InChI | InChI=1S/C16H20N2O3/c1-18-9-7-16(19,8-10-18)15-11-14(17-21-15)12-3-5-13(20-2)6-4-12/h3-6,11,19H,7-10H2,1-2H3 |
| InChIKey | MLWLWEGDMCSRNJ-UHFFFAOYSA-N |
| SMILES | OC1(CCN(CC1)C)C=1ON=C(C1)C1=CC=C(C=C1)OC |