CID 21998160

3-aminopyrrolidine-2-carboxylic acid

Structural Information

Molecular Formula
C5H10N2O2
SMILES
C1CNC(C1N)C(=O)O
InChI
InChI=1S/C5H10N2O2/c6-3-1-2-7-4(3)5(8)9/h3-4,7H,1-2,6H2,(H,8,9)
InChIKey
VJLXSTXGGXYQCT-UHFFFAOYSA-N
Compound name
3-aminopyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

130.07423 Da
Monoisotopic Mass

-3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.08151 126.8
[M+Na]+ 153.06345 132.8
[M-H]- 129.06695 125.7
[M+NH4]+ 148.10805 147.1
[M+K]+ 169.03739 131.1
[M+H-H2O]+ 113.07149 121.1
[M+HCOO]- 175.07243 146.1
[M+CH3COO]- 189.08808 166.9
[M+Na-2H]- 151.04890 129.1
[M]+ 130.07368 119.8
[M]- 130.07478 119.8
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