CID 18218

3038-60-6

Structural Information

Molecular Formula
C11H11F3N2
SMILES
C1CN=C(N1)CC2=CC=C(C=C2)C(F)(F)F
InChI
InChI=1S/C11H11F3N2/c12-11(13,14)9-3-1-8(2-4-9)7-10-15-5-6-16-10/h1-4H,5-7H2,(H,15,16)
InChIKey
OXIKUCONSRWLPM-UHFFFAOYSA-N
Compound name
2-[[4-(trifluoromethyl)phenyl]methyl]-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.08743 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.09471 152.3
[M+Na]+ 251.07665 161.2
[M+NH4]+ 246.12125 157.8
[M+K]+ 267.05059 157.2
[M-H]- 227.08015 149.7
[M+Na-2H]- 249.06210 157.1
[M]+ 228.08688 152.5
[M]- 228.08798 152.5
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.