| SpectraBase Spectrum ID |
GbApAvLyGso |
| Name |
2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]butyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-3-yl)-5-isoxazolyl]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
402.215472069 u |
| Formula |
C22H30N2O5 |
| InChI |
InChI=1S/C22H30N2O5/c1-3-5-10-28-23-17(7-4-2)22-19(25)11-16(12-20(22)26)21-13-18(24-29-21)15-8-6-9-27-14-15/h3,5,13,15-16,25H,4,6-12,14H2,1-2H3/b5-3+,23-17+ |
| InChIKey |
PNHAVOLIYZRZKF-UZQQDAKOSA-N |
| Molecular Weight |
402.491 g/mol |
| SMILES |
OC=1CC(C2=CC(=NO2)C2COCCC2)CC(C1\C(CCC)=N\OC\C=C\C)=O |
![2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]butyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-3-yl)-5-isoxazolyl]-](/api/spectrum/GbApAvLyGso/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 2-[1-[(2-butenyloxy)imino]butyl]-3-hydroxy-5-[3-(tetrahydro-2H-pyran-3-yl)-5-isoxazolyl]-")
