CID 6481803

1-(2-chlorophenyl)-n-[3-(imidazol-1-ylmethyl)phenyl]methanimine

Structural Information

Molecular Formula
C17H14ClN3
SMILES
C1=CC=C(C(=C1)C=NC2=CC=CC(=C2)CN3C=CN=C3)Cl
InChI
InChI=1S/C17H14ClN3/c18-17-7-2-1-5-15(17)11-20-16-6-3-4-14(10-16)12-21-9-8-19-13-21/h1-11,13H,12H2
InChIKey
JUGCXPPUVNXFLS-UHFFFAOYSA-N
Compound name
1-(2-chlorophenyl)-N-[3-(imidazol-1-ylmethyl)phenyl]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.08762 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.09490 168.5
[M+Na]+ 318.07684 177.6
[M-H]- 294.08034 176.6
[M+NH4]+ 313.12144 183.7
[M+K]+ 334.05078 170.4
[M+H-H2O]+ 278.08488 158.1
[M+HCOO]- 340.08582 189.2
[M+CH3COO]- 354.10147 180.4
[M+Na-2H]- 316.06229 173.3
[M]+ 295.08707 171.0
[M]- 295.08817 171.0
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.