| SpectraBase Spectrum ID |
3CN5j1Ht3Yi |
| Name |
4-(4-Isopropyl-phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-quinoline-3-carboxylic acid 2-methoxy-ethyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
411.240958543 u |
| Formula |
C25H33NO4 |
| InChI |
InChI=1S/C25H33NO4/c1-15(2)17-7-9-18(10-8-17)22-21(24(28)30-12-11-29-6)16(3)26-19-13-25(4,5)14-20(27)23(19)22/h7-10,15,22,26H,11-14H2,1-6H3 |
| InChIKey |
KMBQNOXZGAYIMC-UHFFFAOYSA-N |
| Molecular Weight |
411.542 g/mol |
| SMILES |
C1(=C(NC2=C(C1C1=CC=C(C(C)C)C=C1)C(CC(C2)(C)C)=O)C)C(=O)OCCOC |
