| SpectraBase Spectrum ID |
AFffcl6H9df |
| Name |
(Z)-6-[2-Acetyl-3,4-dihydro-6,7-dimethoxy-1(2H)-isoquinolinyliden]hexanoic acid methylester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
361.188922968 u |
| Formula |
C20H27NO5 |
| InChI |
InChI=1S/C20H27NO5/c1-14(22)21-11-10-15-12-18(24-2)19(25-3)13-16(15)17(21)8-6-5-7-9-20(23)26-4/h8,12-13H,5-7,9-11H2,1-4H3/b17-8- |
| InChIKey |
HMZOQLZZOBUJRG-IUXPMGMMSA-N |
| Molecular Weight |
361.438 g/mol |
| SMILES |
C1N(\C(C=2C=C(C(=CC2C1)OC)OC)=C\CCCCC(OC)=O)C(C)=O |
![(Z)-6-[2-Acetyl-3,4-dihydro-6,7-dimethoxy-1(2H)-isoquinolinyliden]hexanoic acid methylester](/api/spectrum/AFffcl6H9df/structure.png?h=300&w=458 "(Z)-6-[2-Acetyl-3,4-dihydro-6,7-dimethoxy-1(2H)-isoquinolinyliden]hexanoic acid methylester")
