CID 57768850

883731-65-5

Structural Information

Molecular Formula
C5H8F2O
SMILES
C1CC(CC1O)(F)F
InChI
InChI=1S/C5H8F2O/c6-5(7)2-1-4(8)3-5/h4,8H,1-3H2
InChIKey
UXEMHKAZXAHULD-UHFFFAOYSA-N
Compound name
3,3-difluorocyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

88
Patents

122.05432 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 123.06160 119.4
[M+Na]+ 145.04354 127.8
[M-H]- 121.04704 119.3
[M+NH4]+ 140.08814 144.8
[M+K]+ 161.01748 126.4
[M+H-H2O]+ 105.05158 114.3
[M+HCOO]- 167.05252 139.6
[M+CH3COO]- 181.06817 165.6
[M+Na-2H]- 143.02899 124.4
[M]+ 122.05377 113.4
[M]- 122.05487 113.4
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