CID 13419852

16257-89-9

Structural Information

Molecular Formula
C5H10N2O2
SMILES
C1[C@H](CN[C@@H]1C(=O)O)N
InChI
InChI=1S/C5H10N2O2/c6-3-1-4(5(8)9)7-2-3/h3-4,7H,1-2,6H2,(H,8,9)/t3-,4+/m1/s1
InChIKey
SHINASQYHDCLEU-DMTCNVIQSA-N
Compound name
(2S,4R)-4-aminopyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

12
References

336
Patents

130.07423 Da
Monoisotopic Mass

-3.6
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

literature stripe

Patent stripe

patents stripe