| SpectraBase Spectrum ID |
1WrtX2ykcDU |
| Name |
2-(4-Ketocyclohexanecarbonyl)-3,6,7,11B-tetrahydro-1H-pyrazin[2,1-A]isoquinolin-4-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.163042573 u |
| Formula |
C19H22N2O3 |
| InChI |
InChI=1S/C19H22N2O3/c22-15-7-5-14(6-8-15)19(24)20-11-17-16-4-2-1-3-13(16)9-10-21(17)18(23)12-20/h1-4,14,17H,5-12H2 |
| InChIKey |
HNIDYTQURQDBHQ-UHFFFAOYSA-N |
| Molecular Weight |
326.396 g/mol |
| SMILES |
C(N1CC2C3=C(C=CC=C3)CCN2C(C1)=O)(C1CCC(CC1)=O)=O |
![2-(4-ketocyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazin[2,1-a]isoquinolin-4-one](/api/spectrum/1WrtX2ykcDU/structure.png?h=300&w=458 "2-(4-ketocyclohexanecarbonyl)-3,6,7,11b-tetrahydro-1H-pyrazin[2,1-a]isoquinolin-4-one")
