CID 5482473

N-benzyloxy-1-(4-chlorophenyl)-2-imidazol-1-yl-ethanimine

Structural Information

Molecular Formula
C18H16ClN3O
SMILES
C1=CC=C(C=C1)CO/N=C(\CN2C=CN=C2)/C3=CC=C(C=C3)Cl
InChI
InChI=1S/C18H16ClN3O/c19-17-8-6-16(7-9-17)18(12-22-11-10-20-14-22)21-23-13-15-4-2-1-3-5-15/h1-11,14H,12-13H2/b21-18+
InChIKey
ZOUMNKTXRKSWFT-DYTRJAOYSA-N
Compound name
(Z)-1-(4-chlorophenyl)-2-imidazol-1-yl-N-phenylmethoxyethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

325.09818 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.10546 175.5
[M+Na]+ 348.08740 182.6
[M-H]- 324.09090 183.3
[M+NH4]+ 343.13200 188.9
[M+K]+ 364.06134 176.5
[M+H-H2O]+ 308.09544 164.7
[M+HCOO]- 370.09638 195.0
[M+CH3COO]- 384.11203 186.3
[M+Na-2H]- 346.07285 179.5
[M]+ 325.09763 178.7
[M]- 325.09873 178.7
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.