CID 42526

1-(bis(2-(dimethylamino)ethyl)amino)-5-methyl-3-phenylindole dihydrochloride

Structural Information

Molecular Formula
C23H32N4
SMILES
CC1=CC2=C(C=C1)N(C=C2C3=CC=CC=C3)N(CCN(C)C)CCN(C)C
InChI
InChI=1S/C23H32N4/c1-19-11-12-23-21(17-19)22(20-9-7-6-8-10-20)18-27(23)26(15-13-24(2)3)16-14-25(4)5/h6-12,17-18H,13-16H2,1-5H3
InChIKey
FJAGNQPAYBZUBI-UHFFFAOYSA-N
Compound name
N'-[2-(dimethylamino)ethyl]-N,N-dimethyl-N'-(5-methyl-3-phenylindol-1-yl)ethane-1,2-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

364.2627 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.26998 192.8
[M+Na]+ 387.25192 205.3
[M+NH4]+ 382.29652 201.2
[M+K]+ 403.22586 198.5
[M-H]- 363.25542 200.0
[M+Na-2H]- 385.23737 201.2
[M]+ 364.26215 196.7
[M]- 364.26325 196.7
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