CID 6479463

1-[(z)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]but-1-enyl]imidazole

Structural Information

Molecular Formula
C20H17Cl3N2O
SMILES
CC/C=C(/C1=C(C=CC(=C1)Cl)OCC2=C(C=C(C=C2)Cl)Cl)\N3C=CN=C3
InChI
InChI=1S/C20H17Cl3N2O/c1-2-3-19(25-9-8-24-13-25)17-10-15(21)6-7-20(17)26-12-14-4-5-16(22)11-18(14)23/h3-11,13H,2,12H2,1H3/b19-3-
InChIKey
UZQZKENZESOLEQ-OQOIWIOPSA-N
Compound name
1-[(Z)-1-[5-chloro-2-[(2,4-dichlorophenyl)methoxy]phenyl]but-1-enyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

406.04065 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.04793 193.0
[M+Na]+ 429.02987 202.6
[M-H]- 405.03337 197.8
[M+NH4]+ 424.07447 204.2
[M+K]+ 445.00381 193.8
[M+H-H2O]+ 389.03791 183.3
[M+HCOO]- 451.03885 198.4
[M+CH3COO]- 465.05450 201.7
[M+Na-2H]- 427.01532 190.7
[M]+ 406.04010 198.2
[M]- 406.04120 198.2
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.