![Cyclohexanol, 1-[3-(4-methoxyphenyl)-5-isoxazolyl]-](/api/spectrum/6AnVsjFBx2o/structure.png?h=300&w=458 "Cyclohexanol, 1-[3-(4-methoxyphenyl)-5-isoxazolyl]-")
| SpectraBase Compound ID | K2ojMbGDCIE |
|---|---|
| InChI | InChI=1S/C16H19NO3/c1-19-13-7-5-12(6-8-13)14-11-15(20-17-14)16(18)9-3-2-4-10-16/h5-8,11,18H,2-4,9-10H2,1H3 |
| InChIKey | JNJDFBDWIZJCLQ-UHFFFAOYSA-N |
| Mol Weight | 273.33 g/mol |
| Molecular Formula | C16H19NO3 |
| Exact Mass | 273.136493 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 6AnVsjFBx2o |
|---|---|
| Name | Cyclohexanol, 1-[3-(4-methoxyphenyl)-5-isoxazolyl]- |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 273.136493473 u |
| Formula | C16H19NO3 |
| InChI | InChI=1S/C16H19NO3/c1-19-13-7-5-12(6-8-13)14-11-15(20-17-14)16(18)9-3-2-4-10-16/h5-8,11,18H,2-4,9-10H2,1H3 |
| InChIKey | JNJDFBDWIZJCLQ-UHFFFAOYSA-N |
| Molecular Weight | 273.332 g/mol |
| SMILES | OC1(CCCCC1)C=1ON=C(C1)C1=CC=C(C=C1)OC |