CID 3011498

[(1s,2r)-2-fluoro-2-phenyl-cyclopropyl]methanol

Structural Information

Molecular Formula
C10H11FO
SMILES
C1[C@H]([C@]1(C2=CC=CC=C2)F)CO
InChI
InChI=1S/C10H11FO/c11-10(6-9(10)7-12)8-4-2-1-3-5-8/h1-5,9,12H,6-7H2/t9-,10-/m0/s1
InChIKey
AUXKTRHHSROWHO-UWVGGRQHSA-N
Compound name
[(1S,2R)-2-fluoro-2-phenylcyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

166.07939 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.08667 130.1
[M+Na]+ 189.06861 140.2
[M-H]- 165.07211 135.7
[M+NH4]+ 184.11321 147.2
[M+K]+ 205.04255 137.5
[M+H-H2O]+ 149.07665 124.0
[M+HCOO]- 211.07759 152.3
[M+CH3COO]- 225.09324 179.2
[M+Na-2H]- 187.05406 137.8
[M]+ 166.07884 130.8
[M]- 166.07994 130.8
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

No patent data available for this compound.