CID 3023569

94108-46-0

Structural Information

Molecular Formula
C10H18N2O3
SMILES
CN(C)CCCN1CC(CC1=O)C(=O)O
InChI
InChI=1S/C10H18N2O3/c1-11(2)4-3-5-12-7-8(10(14)15)6-9(12)13/h8H,3-7H2,1-2H3,(H,14,15)
InChIKey
MUPFIGLSLOVQLZ-UHFFFAOYSA-N
Compound name
1-[3-(dimethylamino)propyl]-5-oxopyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

42
Patents

214.13174 Da
Monoisotopic Mass

-2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.139016 148.9
[M+Na]+ 237.120958 154.6
[M-H]- 213.124464 150.8
[M+NH4]+ 232.165563 167.7
[M+K]+ 253.094898 154.2
[M+H-H2O]+ 197.129000 142.4
[M+HCOO]- 259.129941 169.7
[M+CH3COO]- 273.145591 191.1
[M+Na-2H]- 235.106406 149.0
[M]+ 214.13119142 149.1
[M]- 214.13228858 149.1
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.