CID 64924078

2416243-48-4

Structural Information

Molecular Formula
C12H16Cl2N2
SMILES
CC1(CN(CCN1)C2=CC(=C(C=C2)Cl)Cl)C
InChI
InChI=1S/C12H16Cl2N2/c1-12(2)8-16(6-5-15-12)9-3-4-10(13)11(14)7-9/h3-4,7,15H,5-6,8H2,1-2H3
InChIKey
YZLRWCFOPOOJJQ-UHFFFAOYSA-N
Compound name
1-(3,4-dichlorophenyl)-3,3-dimethylpiperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.06906 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.07634 155.6
[M+Na]+ 281.05828 170.8
[M+NH4]+ 276.10288 166.1
[M+K]+ 297.03222 160.3
[M-H]- 257.06178 159.0
[M+Na-2H]- 279.04373 164.4
[M]+ 258.06851 159.6
[M]- 258.06961 159.6
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.