| SpectraBase Spectrum ID |
3XZX5WXOdxG |
| Name |
2,3-Dicyano-5-methyl-7-[2-(2,3,6,7-tetrahydro-1H,5H-benzo[ij]quinolizin-9-yl)ethenyl]-6H-1,4-diazepine |
| Alternate Name(s) |
5-methyl-7-[(E)-2-(2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-9-yl)ethenyl]-6H-1,4-diazepine-2,3-dicarbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H21N5 |
| InChI |
InChI=1S/C22H21N5/c1-15-10-19(26-21(14-24)20(13-23)25-15)7-6-16-11-17-4-2-8-27-9-3-5-18(12-16)22(17)27/h6-7,11-12H,2-5,8-10H2,1H3/b7-6+ |
| InChIKey |
UGXRRZQLHYQZQA-VOTSOKGWSA-N |
| Molecular Weight |
355.445 g/mol |
| SMILES |
C=1(N=C(CC(=NC1C#N)C)\C=C\c1cc2CCCN3CCCc(c23)c1)C#N |
| SPLASH |
splash10-0a4i-0009000000-cde4a213ee87a2833ab5 |
| Source of Spectrum |
HC-78-321-18 |
| Wiley ID |
1612696 |
![2,3-Dicyano-5-methyl-7-[2-(2,3,6,7-tetrahydro-1H,5H-benzo[ij]quinolizin-9-yl)ethenyl]-6H-1,4-diazepine](/api/spectrum/3XZX5WXOdxG/structure.png?h=300&w=458 "2,3-Dicyano-5-methyl-7-[2-(2,3,6,7-tetrahydro-1H,5H-benzo[ij]quinolizin-9-yl)ethenyl]-6H-1,4-diazepine")
