CID 236191

6941-73-7

Structural Information

Molecular Formula
C24H21N3
SMILES
C1=CC=C(C(=C1)CC(C2=CNC3=CC=CC=C32)C4=CNC5=CC=CC=C54)N
InChI
InChI=1S/C24H21N3/c25-22-10-4-1-7-16(22)13-19(20-14-26-23-11-5-2-8-17(20)23)21-15-27-24-12-6-3-9-18(21)24/h1-12,14-15,19,26-27H,13,25H2
InChIKey
GDGIXKWOJJMLNP-UHFFFAOYSA-N
Compound name
2-[2,2-bis(1H-indol-3-yl)ethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

155
Patents

351.17355 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.18083 181.7
[M+Na]+ 374.16277 190.3
[M-H]- 350.16627 189.0
[M+NH4]+ 369.20737 195.4
[M+K]+ 390.13671 180.8
[M+H-H2O]+ 334.17081 172.8
[M+HCOO]- 396.17175 201.7
[M+CH3COO]- 410.18740 191.7
[M+Na-2H]- 372.14822 184.5
[M]+ 351.17300 180.4
[M]- 351.17410 180.4
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.