CID 212381

24269-44-1

Structural Information

Molecular Formula
C12H25N3O2
SMILES
CCN(CC)CCN1CCN(CC1)C(=O)OC
InChI
InChI=1S/C12H25N3O2/c1-4-13(5-2)6-7-14-8-10-15(11-9-14)12(16)17-3/h4-11H2,1-3H3
InChIKey
JZRLMISAHPDFHX-UHFFFAOYSA-N
Compound name
methyl 4-[2-(diethylamino)ethyl]piperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.19467 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.20195 159.9
[M+Na]+ 266.18389 168.0
[M+NH4]+ 261.22849 165.9
[M+K]+ 282.15783 163.2
[M-H]- 242.18739 159.9
[M+Na-2H]- 264.16934 162.5
[M]+ 243.19412 160.6
[M]- 243.19522 160.6
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.