| SpectraBase Spectrum ID |
7WFKwoP50un |
| Name |
2-(4-Fluorobenzoyl)-3,6,7,11B-tetrahydro-1H-pyrazino[2,1-A]isoquinolin-4-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
324.127405956 u |
| Formula |
C19H17FN2O2 |
| InChI |
InChI=1S/C19H17FN2O2/c20-15-7-5-14(6-8-15)19(24)21-11-17-16-4-2-1-3-13(16)9-10-22(17)18(23)12-21/h1-8,17H,9-12H2 |
| InChIKey |
RWQQSRDAZCPNIB-UHFFFAOYSA-N |
| Molecular Weight |
324.355 g/mol |
| SMILES |
C(N1CC2C3=C(C=CC=C3)CCN2C(C1)=O)(C1=CC=C(C=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.816724 |
![2-(4-fluorobenzoyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one](/api/spectrum/7WFKwoP50un/structure.png?h=300&w=458 "2-(4-fluorobenzoyl)-3,6,7,11b-tetrahydro-1H-pyrazino[2,1-a]isoquinolin-4-one")
