| SpectraBase Spectrum ID |
30Jwgl1X9sD |
| Name |
6-Butyl-2,3-dicyano-5-{4-[bis(2,5,8,11-tetraoxa-13-tridecanyl)amino]styryl}-7-methyl-6H-1,4-diazepine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
711.420713807 u |
| Formula |
C38H57N5O8 |
| InChI |
InChI=1S/C38H57N5O8/c1-5-6-7-35-32(2)41-37(30-39)38(31-40)42-36(35)13-10-33-8-11-34(12-9-33)43(14-16-46-22-24-50-28-26-48-20-18-44-3)15-17-47-23-25-51-29-27-49-21-19-45-4/h8-13,35H,5-7,14-29H2,1-4H3/b13-10+ |
| InChIKey |
FYGBBEASCGKSCW-JLHYYAGUSA-N |
| SMILES |
C=1(N=C(C(C(=NC1C#N)C)CCCC)\C=C\C=1C=CC(N(CCOCCOCCOCCOC)CCOCCOCCOCCOC)=CC1)C#N |
![6-Butyl-2,3-dicyano-5-{4-[bis(2,5,8,11-tetraoxa-13-tridecanyl)amino]styryl}-7-methyl-6H-1,4-diazepine](/api/spectrum/30Jwgl1X9sD/structure.png?h=300&w=458 "6-Butyl-2,3-dicyano-5-{4-[bis(2,5,8,11-tetraoxa-13-tridecanyl)amino]styryl}-7-methyl-6H-1,4-diazepine")
