CID 2782524

Methyl 2-fluoroacrylate

Structural Information

Molecular Formula
C4H5FO2
SMILES
COC(=O)C(=C)F
InChI
InChI=1S/C4H5FO2/c1-3(5)4(6)7-2/h1H2,2H3
InChIKey
ZTZJVAOTIOAZGZ-UHFFFAOYSA-N
Compound name
methyl 2-fluoroprop-2-enoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

1631
Patents

104.02736 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 105.034636 115.1
[M+Na]+ 127.016578 123.4
[M-H]- 103.020084 114.6
[M+NH4]+ 122.061183 138.1
[M+K]+ 142.990518 124.0
[M+H-H2O]+ 87.024620 110.3
[M+HCOO]- 149.025561 137.4
[M+CH3COO]- 163.041211 167.0
[M+Na-2H]- 125.002026 120.3
[M]+ 104.02681142 114.5
[M]- 104.02790858 114.5
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