CID 39237981

2-[2-(4-methylpiperazin-1-yl)ethoxy]ethan-1-amine trihydrochloride

Structural Information

Molecular Formula
C9H21N3O
SMILES
CN1CCN(CC1)CCOCCN
InChI
InChI=1S/C9H21N3O/c1-11-3-5-12(6-4-11)7-9-13-8-2-10/h2-10H2,1H3
InChIKey
GGEXMRSHECRBJZ-UHFFFAOYSA-N
Compound name
2-[2-(4-methylpiperazin-1-yl)ethoxy]ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

187.16846 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.175736 145.8
[M+Na]+ 210.157678 150.2
[M-H]- 186.161184 144.9
[M+NH4]+ 205.202283 162.3
[M+K]+ 226.131618 148.8
[M+H-H2O]+ 170.165720 137.8
[M+HCOO]- 232.166661 164.0
[M+CH3COO]- 246.182311 185.1
[M+Na-2H]- 208.143126 149.5
[M]+ 187.16791142 142.5
[M]- 187.16900858 142.5
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