CID 137952316

2219353-68-9

Structural Information

Molecular Formula
C6H10FNO2
SMILES
C1[C@H](CN[C@@H]1CC(=O)O)F
InChI
InChI=1S/C6H10FNO2/c7-4-1-5(8-3-4)2-6(9)10/h4-5,8H,1-3H2,(H,9,10)/t4-,5+/m1/s1
InChIKey
RELUHGZYAOGPIR-UHNVWZDZSA-N
Compound name
2-[(2R,4R)-4-fluoropyrrolidin-2-yl]acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

147.06955 Da
Monoisotopic Mass

-2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.07683 129.6
[M+Na]+ 170.05877 136.1
[M-H]- 146.06227 127.5
[M+NH4]+ 165.10337 149.8
[M+K]+ 186.03271 134.2
[M+H-H2O]+ 130.06681 123.4
[M+HCOO]- 192.06775 147.1
[M+CH3COO]- 206.08340 168.3
[M+Na-2H]- 168.04422 131.5
[M]+ 147.06900 123.6
[M]- 147.07010 123.6
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.