CID 28704554

4-(4-aminophenyl)-n,n-dimethyl-1-piperazineethanamine

Structural Information

Molecular Formula
C14H24N4
SMILES
CN(C)CCN1CCN(CC1)C2=CC=C(C=C2)N
InChI
InChI=1S/C14H24N4/c1-16(2)7-8-17-9-11-18(12-10-17)14-5-3-13(15)4-6-14/h3-6H,7-12,15H2,1-2H3
InChIKey
MDXCVBZKQDAXEL-UHFFFAOYSA-N
Compound name
4-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

66
Patents

248.2001 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.20738 161.3
[M+Na]+ 271.18932 165.2
[M-H]- 247.19282 165.1
[M+NH4]+ 266.23392 175.5
[M+K]+ 287.16326 162.4
[M+H-H2O]+ 231.19736 151.5
[M+HCOO]- 293.19830 180.7
[M+CH3COO]- 307.21395 203.3
[M+Na-2H]- 269.17477 164.1
[M]+ 248.19955 156.8
[M]- 248.20065 156.8
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

patents stripe