CID 1043070

9h-imidazo(1,2-a)benzimidazole, 9-(2-(diethylamino)ethyl)-2-(1-naphthyl)-, dihydrochloride

Structural Information

Molecular Formula
C25H26N4
SMILES
CCN(CC)CCN1C2=CC=CC=C2N3C1=NC(=C3)C4=CC=CC5=CC=CC=C54
InChI
InChI=1S/C25H26N4/c1-3-27(4-2)16-17-28-23-14-7-8-15-24(23)29-18-22(26-25(28)29)21-13-9-11-19-10-5-6-12-20(19)21/h5-15,18H,3-4,16-17H2,1-2H3
InChIKey
YYVBPFPECROXLP-UHFFFAOYSA-N
Compound name
N,N-diethyl-2-(2-naphthalen-1-ylimidazo[1,2-a]benzimidazol-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

382.21576 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.22304 195.7
[M+Na]+ 405.20498 205.7
[M-H]- 381.20848 203.4
[M+NH4]+ 400.24958 210.4
[M+K]+ 421.17892 198.1
[M+H-H2O]+ 365.21302 184.7
[M+HCOO]- 427.21396 217.1
[M+CH3COO]- 441.22961 206.1
[M+Na-2H]- 403.19043 198.8
[M]+ 382.21521 202.4
[M]- 382.21631 202.4
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.