CID 11008259

1-cyclohexyl-2,2-difluoroethan-1-ol

Structural Information

Molecular Formula
C8H14F2O
SMILES
C1CCC(CC1)C(C(F)F)O
InChI
InChI=1S/C8H14F2O/c9-8(10)7(11)6-4-2-1-3-5-6/h6-8,11H,1-5H2
InChIKey
XQWBMOVANRFWLI-UHFFFAOYSA-N
Compound name
1-cyclohexyl-2,2-difluoroethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.10127 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.10855 135.2
[M+Na]+ 187.09049 139.0
[M-H]- 163.09399 133.7
[M+NH4]+ 182.13509 154.6
[M+K]+ 203.06443 137.7
[M+H-H2O]+ 147.09853 128.2
[M+HCOO]- 209.09947 150.3
[M+CH3COO]- 223.11512 176.0
[M+Na-2H]- 185.07594 136.6
[M]+ 164.10072 126.3
[M]- 164.10182 126.3
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

No patent data available for this compound.