CID 82889193

Methyl 2-{[2-(4-methylpiperazin-1-yl)ethyl]amino}acetate

Structural Information

Molecular Formula
C10H21N3O2
SMILES
CN1CCN(CC1)CCNCC(=O)OC
InChI
InChI=1S/C10H21N3O2/c1-12-5-7-13(8-6-12)4-3-11-9-10(14)15-2/h11H,3-9H2,1-2H3
InChIKey
HOIJEFUAGLMIGM-UHFFFAOYSA-N
Compound name
methyl 2-[2-(4-methylpiperazin-1-yl)ethylamino]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.16338 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.17066 152.0
[M+Na]+ 238.15260 155.9
[M-H]- 214.15610 151.6
[M+NH4]+ 233.19720 167.4
[M+K]+ 254.12654 155.1
[M+H-H2O]+ 198.16064 143.8
[M+HCOO]- 260.16158 169.9
[M+CH3COO]- 274.17723 190.2
[M+Na-2H]- 236.13805 155.1
[M]+ 215.16283 150.1
[M]- 215.16393 150.1
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.