CID 53963649

(1r,3r)-3-fluorocyclobutan-1-ol

Structural Information

Molecular Formula
C4H7FO
SMILES
C1C(CC1F)O
InChI
InChI=1S/C4H7FO/c5-3-1-4(6)2-3/h3-4,6H,1-2H2
InChIKey
GSESEWCACAKURA-UHFFFAOYSA-N
Compound name
3-fluorocyclobutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

111
Patents

90.048096 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 91.055372 110.9
[M+Na]+ 113.037314 118.0
[M-H]- 89.040820 112.4
[M+NH4]+ 108.081919 127.7
[M+K]+ 129.011254 120.3
[M+H-H2O]+ 73.045356 101.4
[M+HCOO]- 135.046297 131.5
[M+CH3COO]- 149.061947 166.1
[M+Na-2H]- 111.022762 117.4
[M]+ 90.04754742 116.1
[M]- 90.04864458 116.1
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

patents stripe