CID 3060018

1-propanol, 3-((4,5-dihydro-1h-imidazol-2-yl)(1h-indol-3-ylmethyl)amino)-, monohydroiodide

Structural Information

Molecular Formula
C15H20N4O
SMILES
C1CN=C(N1)N(CCCO)CC2=CNC3=CC=CC=C32
InChI
InChI=1S/C15H20N4O/c20-9-3-8-19(15-16-6-7-17-15)11-12-10-18-14-5-2-1-4-13(12)14/h1-2,4-5,10,18,20H,3,6-9,11H2,(H,16,17)
InChIKey
ZHPJJWREEYKEMJ-UHFFFAOYSA-N
Compound name
3-[4,5-dihydro-1H-imidazol-2-yl(1H-indol-3-ylmethyl)amino]propan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.1637 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.17098 163.2
[M+Na]+ 295.15292 173.3
[M+NH4]+ 290.19752 169.9
[M+K]+ 311.12686 171.1
[M-H]- 271.15642 164.6
[M+Na-2H]- 293.13837 168.5
[M]+ 272.16315 164.7
[M]- 272.16425 164.7
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

No patent data available for this compound.