CID 55028

2-(3,4-dichlorophenyl)-1-methylimidazolidine

Structural Information

Molecular Formula
C10H12Cl2N2
SMILES
CN1CCNC1C2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C10H12Cl2N2/c1-14-5-4-13-10(14)7-2-3-8(11)9(12)6-7/h2-3,6,10,13H,4-5H2,1H3
InChIKey
BQLXWXRWZQAZON-UHFFFAOYSA-N
Compound name
2-(3,4-dichlorophenyl)-1-methylimidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.03775 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.04503 149.4
[M+Na]+ 253.02697 158.9
[M-H]- 229.03047 151.1
[M+NH4]+ 248.07157 167.2
[M+K]+ 269.00091 152.4
[M+H-H2O]+ 213.03501 142.6
[M+HCOO]- 275.03595 158.8
[M+CH3COO]- 289.05160 160.9
[M+Na-2H]- 251.01242 150.7
[M]+ 230.03720 147.9
[M]- 230.03830 147.9
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.