CID 3044694

4,5-dihydro-2-(2,2-bis(p-fluorophenyl)cyclopropyl)-1h-imidazole hydrochloride

Structural Information

Molecular Formula
C18H16F2N2
SMILES
C1CN=C(N1)C2CC2(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F
InChI
InChI=1S/C18H16F2N2/c19-14-5-1-12(2-6-14)18(13-3-7-15(20)8-4-13)11-16(18)17-21-9-10-22-17/h1-8,16H,9-11H2,(H,21,22)
InChIKey
YYRKLOXDIHNKAR-UHFFFAOYSA-N
Compound name
2-[2,2-bis(4-fluorophenyl)cyclopropyl]-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.12814 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.13542 163.9
[M+Na]+ 321.11736 174.1
[M-H]- 297.12086 170.9
[M+NH4]+ 316.16196 174.5
[M+K]+ 337.09130 167.2
[M+H-H2O]+ 281.12540 153.4
[M+HCOO]- 343.12634 182.1
[M+CH3COO]- 357.14199 174.4
[M+Na-2H]- 319.10281 166.1
[M]+ 298.12759 161.0
[M]- 298.12869 161.0
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.