CID 188987

3-aminopyrrolidine-2,5-dione hydrochloride

Structural Information

Molecular Formula
C4H6N2O2
SMILES
C1C(C(=O)NC1=O)N
InChI
InChI=1S/C4H6N2O2/c5-2-1-3(7)6-4(2)8/h2H,1,5H2,(H,6,7,8)
InChIKey
YDNMHDRXNOHCJH-UHFFFAOYSA-N
Compound name
3-aminopyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

41
References

1266
Patents

114.04293 Da
Monoisotopic Mass

-1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.05021 120.8
[M+Na]+ 137.03215 129.3
[M+NH4]+ 132.07675 127.8
[M+K]+ 153.00609 127.6
[M-H]- 113.03565 120.2
[M+Na-2H]- 135.01760 123.6
[M]+ 114.04238 121.2
[M]- 114.04348 121.2
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

patents stripe