CID 67229356

1803567-20-5

Structural Information

Molecular Formula

C₆H₁₀FNO₂

SMILES

C1CC(CC1N)(C(=O)O)F

InChI

InChI=1S/C6H10FNO2/c7-6(5(9)10)2-1-4(8)3-6/h4H,1-3,8H2,(H,9,10)

InChIKey

HRGGNZAIHYNTCH-UHFFFAOYSA-N

Compound name

3-amino-1-fluorocyclopentane-1-carboxylic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 3
Patents: 147.06955 Da
Monoisotopic Mass: -2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	148.076826	127.9
[M+Na]+	170.058768	134.9
[M-H]-	146.062274	128.5
[M+NH4]+	165.103373	151.6
[M+K]+	186.032708	133.6
[M+H-H2O]+	130.066810	123.1
[M+HCOO]-	192.067751	148.6
[M+CH3COO]-	206.083401	172.0
[M+Na-2H]-	168.044216	131.0
[M]+	147.06900142	121.8
[M]-	147.07009858	121.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe