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]+ 105.07102 116.2
[M+Na]+ 127.05296 127.0
[M-H]- 103.05646 119.2
[M+NH4]+ 122.09756 136.1
[M+K]+ 143.02690 125.8
[M+H-H2O]+ 87.061000 111.7
[M+HCOO]- 149.06194 138.1
[M+CH3COO]- 163.07759 169.3
[M+Na-2H]- 125.03841 124.0
[M]+ 104.06319 117.6
[M]- 104.06429 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