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

25
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 124.5
[M+Na]+ 159.05920 131.6
[M-H]- 135.06270 124.1
[M+NH4]+ 154.10380 147.6
[M+K]+ 175.03314 130.1
[M+H-H2O]+ 119.06724 118.9
[M+HCOO]- 181.06818 142.3
[M+CH3COO]- 195.08383 168.9
[M+Na-2H]- 157.04465 130.1
[M]+ 136.06943 116.9
[M]- 136.07053 116.9
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