CID 3056382

73771-03-6

Structural Information

Molecular Formula
C17H19Cl2N
SMILES
CN(CC(C1=CC=CC=C1)Cl)CC(C2=CC=CC=C2)Cl
InChI
InChI=1S/C17H19Cl2N/c1-20(12-16(18)14-8-4-2-5-9-14)13-17(19)15-10-6-3-7-11-15/h2-11,16-17H,12-13H2,1H3
InChIKey
ZZQNXTUQHKCPFK-UHFFFAOYSA-N
Compound name
2-chloro-N-(2-chloro-2-phenylethyl)-N-methyl-2-phenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

307.08945 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 308.096726 170.6
[M+Na]+ 330.078668 176.0
[M-H]- 306.082174 176.7
[M+NH4]+ 325.123273 186.5
[M+K]+ 346.052608 170.1
[M+H-H2O]+ 290.086710 163.6
[M+HCOO]- 352.087651 183.8
[M+CH3COO]- 366.103301 209.0
[M+Na-2H]- 328.064116 172.9
[M]+ 307.08890142 173.8
[M]- 307.08999858 173.8
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.