CID 17609128

2-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine

Structural Information

Molecular Formula
C9H21N3
SMILES
CC(CN)CN1CCN(CC1)C
InChI
InChI=1S/C9H21N3/c1-9(7-10)8-12-5-3-11(2)4-6-12/h9H,3-8,10H2,1-2H3
InChIKey
XXSQACLXBZQBST-UHFFFAOYSA-N
Compound name
2-methyl-3-(4-methylpiperazin-1-yl)propan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.17355 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.180826 143.6
[M+Na]+ 194.162768 147.8
[M-H]- 170.166274 142.9
[M+NH4]+ 189.207373 160.7
[M+K]+ 210.136708 146.4
[M+H-H2O]+ 154.170810 135.9
[M+HCOO]- 216.171751 160.5
[M+CH3COO]- 230.187401 183.9
[M+Na-2H]- 192.148216 146.0
[M]+ 171.17300142 138.2
[M]- 171.17409858 138.2
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.