CID 126677698

2742343-56-0

Structural Information

Molecular Formula
C5H9FO
SMILES
C[C@@H]1C[C@]1(CO)F
InChI
InChI=1S/C5H9FO/c1-4-2-5(4,6)3-7/h4,7H,2-3H2,1H3/t4-,5-/m1/s1
InChIKey
UMDPHASYCCSJIF-RFZPGFLSSA-N
Compound name
[(1S,2R)-1-fluoro-2-methylcyclopropyl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

104.06374 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 105.071016 116.2
[M+Na]+ 127.052958 127.0
[M-H]- 103.056464 119.2
[M+NH4]+ 122.097563 136.1
[M+K]+ 143.026898 125.8
[M+H-H2O]+ 87.061000 111.7
[M+HCOO]- 149.061941 138.1
[M+CH3COO]- 163.077591 169.3
[M+Na-2H]- 125.038406 124.0
[M]+ 104.06319142 117.6
[M]- 104.06428858 117.6
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