CID 46223

Brn 2693280

Structural Information

Molecular Formula
C11H15Cl2N
SMILES
CCN(CCCl)CC1=CC=C(C=C1)Cl
InChI
InChI=1S/C11H15Cl2N/c1-2-14(8-7-12)9-10-3-5-11(13)6-4-10/h3-6H,2,7-9H2,1H3
InChIKey
DQVHBIDSEFMVEU-UHFFFAOYSA-N
Compound name
2-chloro-N-[(4-chlorophenyl)methyl]-N-ethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.05815 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.06543 149.1
[M+Na]+ 254.04737 163.3
[M+NH4]+ 249.09197 159.0
[M+K]+ 270.02131 154.2
[M-H]- 230.05087 152.8
[M+Na-2H]- 252.03282 157.0
[M]+ 231.05760 152.9
[M]- 231.05870 152.9
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.