CID 143213159

3-fluoroprop-1-en-2-ol

Structural Information

Molecular Formula
C3H5FO
SMILES
C=C(CF)O
InChI
InChI=1S/C3H5FO/c1-3(5)2-4/h5H,1-2H2
InChIKey
SNMAHBDDQBYHES-UHFFFAOYSA-N
Compound name
3-fluoroprop-1-en-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

76.03244 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 77.039716 109.7
[M+Na]+ 99.021658 117.8
[M-H]- 75.025164 107.8
[M+NH4]+ 94.066263 133.2
[M+K]+ 114.995598 117.5
[M+H-H2O]+ 59.029700 105.4
[M+HCOO]- 121.030641 131.4
[M+CH3COO]- 135.046291 160.0
[M+Na-2H]- 97.007106 116.2
[M]+ 76.03189142 106.8
[M]- 76.03298858 106.8
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