| SpectraBase Spectrum ID |
KJ23vlRSW9D |
| Name |
2-Cyclohexen-1-one, 3-hydroxy-2-[1-[(4-phenylbutoxy)imino]propyl]-5-(tetrahydro-2H-thiopyran-3-yl)-; 2H-thiopyran, 2-cyclohexen-1-one derivative |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
415.218115098 u |
| Formula |
C24H33NO3S |
| InChI |
InChI=1S/C24H33NO3S/c1-2-21(25-28-13-7-6-11-18-9-4-3-5-10-18)24-22(26)15-20(16-23(24)27)19-12-8-14-29-17-19/h3-5,9-10,19-20,26H,2,6-8,11-17H2,1H3/b25-21+ |
| InChIKey |
QNCRHBQGSAAEKF-NJNXFGOHSA-N |
| Molecular Weight |
415.592 g/mol |
| SMILES |
OC=1CC(C2CCCSC2)CC(C1\C(CC)=N\OCCCCC=1C=CC=CC1)=O |
![2-Cyclohexen-1-one, 3-hydroxy-2-[1-[(4-phenylbutoxy)imino]propyl]-5-(tetrahydro-2H-thiopyran-3-yl)-](/api/spectrum/KJ23vlRSW9D/structure.png?h=300&w=458 "2-Cyclohexen-1-one, 3-hydroxy-2-[1-[(4-phenylbutoxy)imino]propyl]-5-(tetrahydro-2H-thiopyran-3-yl)-")
