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

108
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]+ 113.03731 118.0
[M-H]- 89.040820 112.4
[M+NH4]+ 108.08192 127.7
[M+K]+ 129.01125 120.3
[M+H-H2O]+ 73.045356 101.4
[M+HCOO]- 135.04630 131.5
[M+CH3COO]- 149.06195 166.1
[M+Na-2H]- 111.02276 117.4
[M]+ 90.047547 116.1
[M]- 90.048645 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