| SpectraBase Spectrum ID |
2D5O0leaEaN |
| Name |
1,11-bis[5-(2,2-dicyanovinyl)-2,4-dimethylpyrrol-3-yl)undecane |
| CAS Registry Number |
87280-79-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H38N6 |
| InChI |
InChI=1S/C31H38N6/c1-22-28(24(3)36-30(22)16-26(18-32)19-33)14-12-10-8-6-5-7-9-11-13-15-29-23(2)31(37-25(29)4)17-27(20-34)21-35/h16-17,36-37H,5-15H2,1-4H3 |
| InChIKey |
IHZANCDGVJVTCD-UHFFFAOYSA-N |
| Molecular Weight |
494.687 g/mol |
| SMILES |
[nH]1c(c(CCCCCCCCCCCc2c([nH]c(c2C)C=C(C#N)C#N)C)c(c1C=C(C#N)C#N)C)C |
| SPLASH |
splash10-001l-0900800000-65f5b8b729039c78b678 |
| Source of Spectrum |
J-53-1349-14 |
| Synonyms |
2-[(4-{11-[5-(2,2-dicyanovinyl)-2,4-dimethyl-1H-pyrrol-3-yl]undecyl}-3,5-dimethyl-1H-pyrrol-2-yl)methylene]malononitrile |
| Wiley ID |
1397984 |
