CID 3051354

67428-84-6

Structural Information

Molecular Formula
C12H17Cl2N
SMILES
CCN(CC)CC(C1=CC=C(C=C1)Cl)Cl
InChI
InChI=1S/C12H17Cl2N/c1-3-15(4-2)9-12(14)10-5-7-11(13)8-6-10/h5-8,12H,3-4,9H2,1-2H3
InChIKey
QKRDWMKYUGMFPD-UHFFFAOYSA-N
Compound name
2-chloro-2-(4-chlorophenyl)-N,N-diethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.0738 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.08108 153.9
[M+Na]+ 268.06302 167.6
[M+NH4]+ 263.10762 163.5
[M+K]+ 284.03696 159.1
[M-H]- 244.06652 157.5
[M+Na-2H]- 266.04847 161.3
[M]+ 245.07325 157.6
[M]- 245.07435 157.6
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.