CID 146155057

2416223-34-0

Structural Information

Molecular Formula
C7H12FNO2
SMILES
COC(=O)C(C1CC(C1)N)F
InChI
InChI=1S/C7H12FNO2/c1-11-7(10)6(8)4-2-5(9)3-4/h4-6H,2-3,9H2,1H3
InChIKey
SRTXSEXIKQRRDB-UHFFFAOYSA-N
Compound name
methyl 2-(3-aminocyclobutyl)-2-fluoroacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

161.0852 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 162.092476 135.7
[M+Na]+ 184.074418 140.3
[M-H]- 160.077924 137.4
[M+NH4]+ 179.119023 149.3
[M+K]+ 200.048358 143.4
[M+H-H2O]+ 144.082460 124.0
[M+HCOO]- 206.083401 155.2
[M+CH3COO]- 220.099051 183.6
[M+Na-2H]- 182.059866 136.9
[M]+ 161.08465142 141.1
[M]- 161.08574858 141.1
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.