CID 57356225

Dtxsid001210937

Structural Information

Molecular Formula
C26H28N2
SMILES
CC(=CCCC(=CC(N1C=CC2=CC=CC=C21)N3C=CC4=CC=CC=C43)C)C
InChI
InChI=1S/C26H28N2/c1-20(2)9-8-10-21(3)19-26(27-17-15-22-11-4-6-13-24(22)27)28-18-16-23-12-5-7-14-25(23)28/h4-7,9,11-19,26H,8,10H2,1-3H3
InChIKey
XSHXVCYGTIAJFF-UHFFFAOYSA-N
Compound name
1-(1-indol-1-yl-3,7-dimethylocta-2,6-dienyl)indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

368.22525 Da
Monoisotopic Mass

7.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 369.232526 197.1
[M+Na]+ 391.214468 204.3
[M-H]- 367.217974 203.1
[M+NH4]+ 386.259073 212.1
[M+K]+ 407.188408 196.4
[M+H-H2O]+ 351.222510 187.7
[M+HCOO]- 413.223451 215.9
[M+CH3COO]- 427.239101 206.5
[M+Na-2H]- 389.199916 195.3
[M]+ 368.22470142 200.5
[M]- 368.22579858 200.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.