CID 3070224

86002-65-5

Structural Information

Molecular Formula
C17H19N3
SMILES
CCCN1C(CN=C1C2=CN=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C17H19N3/c1-2-11-20-16(14-7-4-3-5-8-14)13-19-17(20)15-9-6-10-18-12-15/h3-10,12,16H,2,11,13H2,1H3
InChIKey
LHDGLLLGOKWVRJ-UHFFFAOYSA-N
Compound name
3-(5-phenyl-1-propyl-4,5-dihydroimidazol-2-yl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.1579 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.165176 163.2
[M+Na]+ 288.147118 170.6
[M-H]- 264.150624 168.6
[M+NH4]+ 283.191723 177.0
[M+K]+ 304.121058 165.0
[M+H-H2O]+ 248.155160 152.4
[M+HCOO]- 310.156101 183.2
[M+CH3COO]- 324.171751 174.2
[M+Na-2H]- 286.132566 166.6
[M]+ 265.15735142 162.2
[M]- 265.15844858 162.2
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.