CID 43650731

4-[5-(3,4-difluorophenyl)-1h-imidazol-2-yl]piperidine

Structural Information

Molecular Formula
C14H15F2N3
SMILES
C1CNCCC1C2=NC=C(N2)C3=CC(=C(C=C3)F)F
InChI
InChI=1S/C14H15F2N3/c15-11-2-1-10(7-12(11)16)13-8-18-14(19-13)9-3-5-17-6-4-9/h1-2,7-9,17H,3-6H2,(H,18,19)
InChIKey
NNENSCNHBZBIFE-UHFFFAOYSA-N
Compound name
4-[5-(3,4-difluorophenyl)-1H-imidazol-2-yl]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

263.1234 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.13068 159.2
[M+Na]+ 286.11262 166.1
[M-H]- 262.11612 159.3
[M+NH4]+ 281.15722 171.7
[M+K]+ 302.08656 158.8
[M+H-H2O]+ 246.12066 147.8
[M+HCOO]- 308.12160 172.2
[M+CH3COO]- 322.13725 168.2
[M+Na-2H]- 284.09807 159.4
[M]+ 263.12285 149.2
[M]- 263.12395 149.2
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

patents stripe