CID 9964083

(1s,2s)-2-fluorocyclohexan-1-ol

Structural Information

Molecular Formula
C6H11FO
SMILES
C1CC[C@@H]([C@H](C1)O)F
InChI
InChI=1S/C6H11FO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2/t5-,6-/m0/s1
InChIKey
LMYKFDDTPIOYQV-WDSKDSINSA-N
Compound name
(1S,2S)-2-fluorocyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

196
Patents

118.07939 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.08667 122.0
[M+Na]+ 141.06861 128.1
[M-H]- 117.07211 122.6
[M+NH4]+ 136.11321 143.9
[M+K]+ 157.04255 126.9
[M+H-H2O]+ 101.07665 116.6
[M+HCOO]- 163.07759 140.9
[M+CH3COO]- 177.09324 166.5
[M+Na-2H]- 139.05406 127.1
[M]+ 118.07884 115.3
[M]- 118.07994 115.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe