CID 9797240

180869-32-3

Structural Information

Molecular Formula
C19H19FN4
SMILES
C1CNCCC1N2C=NC(=C2C3=CC=NC=C3)C4=CC=C(C=C4)F
InChI
InChI=1S/C19H19FN4/c20-16-3-1-14(2-4-16)18-19(15-5-9-21-10-6-15)24(13-23-18)17-7-11-22-12-8-17/h1-6,9-10,13,17,22H,7-8,11-12H2
InChIKey
QBACMJFLMUCPNA-UHFFFAOYSA-N
Compound name
4-[5-(4-fluorophenyl)-3-piperidin-4-ylimidazol-4-yl]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

204
Patents

322.15936 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.16664 176.8
[M+Na]+ 345.14858 183.1
[M-H]- 321.15208 181.0
[M+NH4]+ 340.19318 185.5
[M+K]+ 361.12252 174.9
[M+H-H2O]+ 305.15662 163.4
[M+HCOO]- 367.15756 190.4
[M+CH3COO]- 381.17321 184.9
[M+Na-2H]- 343.13403 177.5
[M]+ 322.15881 169.2
[M]- 322.15991 169.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe