CID 73556850

Dtxsid20888483

Structural Information

Molecular Formula
C22H24N2
SMILES
CC1=C(C2=CC=CC=C2N1)C=CC3C(C4=CC=CC=C4N3C)(C)C
InChI
InChI=1S/C22H24N2/c1-15-16(17-9-5-7-11-19(17)23-15)13-14-21-22(2,3)18-10-6-8-12-20(18)24(21)4/h5-14,21,23H,1-4H3
InChIKey
NPZLVDFAHKAWQI-UHFFFAOYSA-N
Compound name
1,3,3-trimethyl-2-[2-(2-methyl-1H-indol-3-yl)ethenyl]-2H-indole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

10
Patents

316.19394 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 317.201216 179.6
[M+Na]+ 339.183158 191.0
[M-H]- 315.186664 185.6
[M+NH4]+ 334.227763 199.4
[M+K]+ 355.157098 182.5
[M+H-H2O]+ 299.191200 171.8
[M+HCOO]- 361.192141 198.6
[M+CH3COO]- 375.207791 191.2
[M+Na-2H]- 337.168606 180.2
[M]+ 316.19339142 181.3
[M]- 316.19448858 181.3
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

patents stripe