CID 3054422

Sgd 27077

Structural Information

Molecular Formula
C18H12Cl4N2O2
SMILES
C1=CC(=C(C=C1Cl)Cl)/C(=C\N2C=CN=C2)/OCOC3=C(C=C(C=C3)Cl)Cl
InChI
InChI=1S/C18H12Cl4N2O2/c19-12-1-3-14(15(21)7-12)18(9-24-6-5-23-10-24)26-11-25-17-4-2-13(20)8-16(17)22/h1-10H,11H2/b18-9+
InChIKey
JWMHPKGIIZCHRK-GIJQJNRQSA-N
Compound name
1-[(E)-2-[(2,4-dichlorophenoxy)methoxy]-2-(2,4-dichlorophenyl)ethenyl]imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

427.9653 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 428.97258 191.6
[M+Na]+ 450.95452 201.2
[M-H]- 426.95802 195.0
[M+NH4]+ 445.99912 201.6
[M+K]+ 466.92846 193.8
[M+H-H2O]+ 410.96256 182.4
[M+HCOO]- 472.96350 192.3
[M+CH3COO]- 486.97915 199.5
[M+Na-2H]- 448.93997 189.2
[M]+ 427.96475 196.7
[M]- 427.96585 196.7
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.