CID 3048511

Piperazine, 1-(3,4-dichlorophenyl)-4-methoxypropyl-, sulfate

Structural Information

Molecular Formula
C14H20Cl2N2O
SMILES
COCCCN1CCN(CC1)C2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C14H20Cl2N2O/c1-19-10-2-5-17-6-8-18(9-7-17)12-3-4-13(15)14(16)11-12/h3-4,11H,2,5-10H2,1H3
InChIKey
XSKIRHYYXUROPE-UHFFFAOYSA-N
Compound name
1-(3,4-dichlorophenyl)-4-(3-methoxypropyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.09528 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.10256 167.5
[M+Na]+ 325.08450 182.2
[M+NH4]+ 320.12910 176.0
[M+K]+ 341.05844 173.0
[M-H]- 301.08800 170.8
[M+Na-2H]- 323.06995 174.4
[M]+ 302.09473 171.1
[M]- 302.09583 171.1
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.