CID 60756050

(2,4-difluorophenyl)(1-methyl-1h-imidazol-2-yl)methanamine

Structural Information

Molecular Formula
C11H11F2N3
SMILES
CN1C=CN=C1C(C2=C(C=C(C=C2)F)F)N
InChI
InChI=1S/C11H11F2N3/c1-16-5-4-15-11(16)10(14)8-3-2-7(12)6-9(8)13/h2-6,10H,14H2,1H3
InChIKey
BMXKPFBLESVBPY-UHFFFAOYSA-N
Compound name
(2,4-difluorophenyl)-(1-methylimidazol-2-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.0921 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.099376 145.9
[M+Na]+ 246.081318 155.5
[M-H]- 222.084824 147.8
[M+NH4]+ 241.125923 163.1
[M+K]+ 262.055258 151.3
[M+H-H2O]+ 206.089360 136.1
[M+HCOO]- 268.090301 166.7
[M+CH3COO]- 282.105951 192.1
[M+Na-2H]- 244.066766 147.9
[M]+ 223.09155142 142.5
[M]- 223.09264858 142.5
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.