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]+ 162.09248 135.7
[M+Na]+ 184.07442 140.3
[M-H]- 160.07792 137.4
[M+NH4]+ 179.11902 149.3
[M+K]+ 200.04836 143.4
[M+H-H2O]+ 144.08246 124.0
[M+HCOO]- 206.08340 155.2
[M+CH3COO]- 220.09905 183.6
[M+Na-2H]- 182.05987 136.9
[M]+ 161.08465 141.1
[M]- 161.08575 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.