CID 212405

24269-56-5

Structural Information

Molecular Formula
C13H25N3O2
SMILES
CCOC(=O)N1CCN(CC1)CCN2CCCC2
InChI
InChI=1S/C13H25N3O2/c1-2-18-13(17)16-11-9-15(10-12-16)8-7-14-5-3-4-6-14/h2-12H2,1H3
InChIKey
LDLGFGICPKXZGS-UHFFFAOYSA-N
Compound name
ethyl 4-(2-pyrrolidin-1-ylethyl)piperazine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.19467 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.20195 164.5
[M+Na]+ 278.18389 167.1
[M-H]- 254.18739 165.1
[M+NH4]+ 273.22849 178.5
[M+K]+ 294.15783 165.4
[M+H-H2O]+ 238.19193 154.6
[M+HCOO]- 300.19287 178.3
[M+CH3COO]- 314.20852 192.8
[M+Na-2H]- 276.16934 163.2
[M]+ 255.19412 160.0
[M]- 255.19522 160.0
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.