CID 146946

Aziprin

Structural Information

Molecular Formula
C11H20Cl2N2O2
SMILES
CCOC(=O)[C@@H]1CC(CN1)N(CCCl)CCCl
InChI
InChI=1S/C11H20Cl2N2O2/c1-2-17-11(16)10-7-9(8-14-10)15(5-3-12)6-4-13/h9-10,14H,2-8H2,1H3/t9?,10-/m0/s1
InChIKey
UWJJSBXYRAPJEN-AXDSSHIGSA-N
Compound name
ethyl (2S)-4-[bis(2-chloroethyl)amino]pyrrolidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

282.09018 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.09746 161.9
[M+Na]+ 305.07940 170.2
[M+NH4]+ 300.12400 168.6
[M+K]+ 321.05334 166.1
[M-H]- 281.08290 161.4
[M+Na-2H]- 303.06485 163.9
[M]+ 282.08963 163.0
[M]- 282.09073 163.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.