CID 206194

1h-imidazole, 2-((3,4-dichlorophenoxy)methyl)-, monohydrochloride

Structural Information

Molecular Formula
C10H8Cl2N2O
SMILES
C1=CC(=C(C=C1OCC2=NC=CN2)Cl)Cl
InChI
InChI=1S/C10H8Cl2N2O/c11-8-2-1-7(5-9(8)12)15-6-10-13-3-4-14-10/h1-5H,6H2,(H,13,14)
InChIKey
UMBGCNDSIIGRQD-UHFFFAOYSA-N
Compound name
2-[(3,4-dichlorophenoxy)methyl]-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

242.00137 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.00865 147.9
[M+Na]+ 264.99059 158.5
[M-H]- 240.99409 150.1
[M+NH4]+ 260.03519 165.1
[M+K]+ 280.96453 152.1
[M+H-H2O]+ 224.99863 140.8
[M+HCOO]- 286.99957 160.4
[M+CH3COO]- 301.01522 160.2
[M+Na-2H]- 262.97604 152.1
[M]+ 242.00082 150.5
[M]- 242.00192 150.5
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

patents stripe