CID 12042411

441033-40-5

Structural Information

Molecular Formula
C14H16FN3
SMILES
C1CNCCC1C2=NC=C(N2)C3=CC=C(C=C3)F
InChI
InChI=1S/C14H16FN3/c15-12-3-1-10(2-4-12)13-9-17-14(18-13)11-5-7-16-8-6-11/h1-4,9,11,16H,5-8H2,(H,17,18)
InChIKey
UXDZOEUAAPXRGP-UHFFFAOYSA-N
Compound name
4-[5-(4-fluorophenyl)-1H-imidazol-2-yl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

245.13283 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.14011 156.0
[M+Na]+ 268.12205 161.9
[M-H]- 244.12555 157.1
[M+NH4]+ 263.16665 169.0
[M+K]+ 284.09599 155.2
[M+H-H2O]+ 228.13009 145.3
[M+HCOO]- 290.13103 170.1
[M+CH3COO]- 304.14668 165.2
[M+Na-2H]- 266.10750 157.6
[M]+ 245.13228 146.6
[M]- 245.13338 146.6
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