CID 69303179

2,2-difluorocyclohexan-1-ol

Structural Information

Molecular Formula
C6H10F2O
SMILES
C1CCC(C(C1)O)(F)F
InChI
InChI=1S/C6H10F2O/c7-6(8)4-2-1-3-5(6)9/h5,9H,1-4H2
InChIKey
ZSXZEFJVQNNWLJ-UHFFFAOYSA-N
Compound name
2,2-difluorocyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

136.06998 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.07726 129.1
[M+Na]+ 159.05920 138.3
[M+NH4]+ 154.10380 138.2
[M+K]+ 175.03314 131.0
[M-H]- 135.06270 127.9
[M+Na-2H]- 157.04465 134.3
[M]+ 136.06943 129.9
[M]- 136.07053 129.9
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