| SpectraBase Spectrum ID |
CxvVSfrbygZ |
| Name |
1,1'-Bisisoquinoline, 2,2'-diacetyl-1,1',2,2'-tetrahydro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
344.152477890 u |
| Formula |
C22H20N2O2 |
| InChI |
InChI=1S/C22H20N2O2/c1-15(25)23-13-11-17-7-3-5-9-19(17)21(23)22-20-10-6-4-8-18(20)12-14-24(22)16(2)26/h3-14,21-22H,1-2H3 |
| InChIKey |
CUVGSISUAFZDNL-UHFFFAOYSA-N |
| Molecular Weight |
344.414 g/mol |
| SMILES |
C1=2C(N(C=CC2C=CC=C1)C(C)=O)C1C2=C(C=CC=C2)C=CN1C(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.893484 |
