![2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]propyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-4-yl)-5-isoxazolyl]-](/api/spectrum/GHTZ6PP7zgn/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]propyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-4-yl)-5-isoxazolyl]-")
| SpectraBase Compound ID | LYzq9yZ4BZy |
|---|---|
| InChI | InChI=1S/C21H28N2O5/c1-3-5-8-27-22-16(4-2)21-18(24)11-15(12-19(21)25)20-13-17(23-28-20)14-6-9-26-10-7-14/h3,5,13-15,24H,4,6-12H2,1-2H3/b5-3+,22-16+ |
| InChIKey | WPLMWRPHKDKVCU-BCRXBJKHSA-N |
| Mol Weight | 388.46 g/mol |
| Molecular Formula | C21H28N2O5 |
| Exact Mass | 388.199822 g/mol |
Transmission Infrared (IR) Spectrum
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| SpectraBase Spectrum ID | GHTZ6PP7zgn |
|---|---|
| Name | 2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]propyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-4-yl)-5-isoxazolyl]- |
| CAS Registry Number | 130113-46-1 |
| Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C21H28N2O5 |
| InChI | InChI=1S/C21H28N2O5/c1-3-5-8-27-22-16(4-2)21-18(24)11-15(12-19(21)25)20-13-17(23-28-20)14-6-9-26-10-7-14/h3,5,13-15,24H,4,6-12H2,1-2H3/b5-3+,22-16+ |
| InChIKey | WPLMWRPHKDKVCU-BCRXBJKHSA-N |
| Instrument Name | Bruker IFS 85 |
| Purity | slightly contaminated |
| Technique | KBr-Pellet |