CID 5482475

N-benzyloxy-1-(2,4-dichlorophenyl)-2-imidazol-1-yl-ethanimine

Structural Information

Molecular Formula
C18H15Cl2N3O
SMILES
C1=CC=C(C=C1)CO/N=C(\CN2C=CN=C2)/C3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C18H15Cl2N3O/c19-15-6-7-16(17(20)10-15)18(11-23-9-8-21-13-23)22-24-12-14-4-2-1-3-5-14/h1-10,13H,11-12H2/b22-18+
InChIKey
JCKASXBBWBBDMP-RELWKKBWSA-N
Compound name
(Z)-1-(2,4-dichlorophenyl)-2-imidazol-1-yl-N-phenylmethoxyethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

359.0592 Da
Monoisotopic Mass

4.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 360.06648 182.5
[M+Na]+ 382.04842 190.9
[M-H]- 358.05192 189.7
[M+NH4]+ 377.09302 195.3
[M+K]+ 398.02236 183.7
[M+H-H2O]+ 342.05646 172.0
[M+HCOO]- 404.05740 196.8
[M+CH3COO]- 418.07305 192.8
[M+Na-2H]- 380.03387 184.8
[M]+ 359.05865 187.4
[M]- 359.05975 187.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.