CID 134819136

2231663-84-4

Structural Information

Molecular Formula

C₆H₁₀FNO₂

SMILES

COC(=O)C1(CC(C1)N)F

InChI

InChI=1S/C6H10FNO2/c1-10-5(9)6(7)2-4(8)3-6/h4H,2-3,8H2,1H3

InChIKey

JDISEPVVHLQPCG-UHFFFAOYSA-N

Compound name

methyl 3-amino-1-fluorocyclobutane-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 147.06955 Da
Monoisotopic Mass: 0.0
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]+	148.07683	134.4
[M+Na]+	170.05877	138.4
[M+NH4]+	165.10337	138.8
[M+K]+	186.03271	134.5
[M-H]-	146.06227	131.0
[M+Na-2H]-	168.04422	136.3
[M]+	147.06900	132.6
[M]-	147.07010	132.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.