CID 43200271

3-(aminomethyl)pyrrolidine-2,5-dione hydrochloride

Structural Information

Molecular Formula
C5H8N2O2
SMILES
C1C(C(=O)NC1=O)CN
InChI
InChI=1S/C5H8N2O2/c6-2-3-1-4(8)7-5(3)9/h3H,1-2,6H2,(H,7,8,9)
InChIKey
GLEJFOKLZHFGPI-UHFFFAOYSA-N
Compound name
3-(aminomethyl)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

128.05858 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.06586 124.1
[M+Na]+ 151.04780 132.0
[M-H]- 127.05130 124.7
[M+NH4]+ 146.09240 145.4
[M+K]+ 167.02174 130.1
[M+H-H2O]+ 111.05584 118.6
[M+HCOO]- 173.05678 146.1
[M+CH3COO]- 187.07243 168.8
[M+Na-2H]- 149.03325 127.5
[M]+ 128.05803 119.3
[M]- 128.05913 119.3
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

patents stripe