CID 36387

Brn 0801105

Structural Information

Molecular Formula
C12H14Cl2N2O
SMILES
CCOC(C1=CC(=C(C=C1)Cl)Cl)C2=NCCN2
InChI
InChI=1S/C12H14Cl2N2O/c1-2-17-11(12-15-5-6-16-12)8-3-4-9(13)10(14)7-8/h3-4,7,11H,2,5-6H2,1H3,(H,15,16)
InChIKey
CDYIJZOLEWUWGK-UHFFFAOYSA-N
Compound name
2-[(3,4-dichlorophenyl)-ethoxymethyl]-4,5-dihydro-1H-imidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.0483 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.05558 158.5
[M+Na]+ 295.03752 167.0
[M-H]- 271.04102 160.2
[M+NH4]+ 290.08212 174.4
[M+K]+ 311.01146 160.7
[M+H-H2O]+ 255.04556 151.2
[M+HCOO]- 317.04650 168.0
[M+CH3COO]- 331.06215 192.5
[M+Na-2H]- 293.02297 159.6
[M]+ 272.04775 159.8
[M]- 272.04885 159.8
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.