CID 71415309

Methyl 2-fluoro-3-methoxyprop-2-enoate

Structural Information

Molecular Formula

SMILES

COC=C(C(=O)OC)F

InChI

InChI=1S/C5H7FO3/c1-8-3-4(6)5(7)9-2/h3H,1-2H3

InChIKey

GEYVOMKNBOZKKB-UHFFFAOYSA-N

Compound name

methyl 2-fluoro-3-methoxyprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 5
Patents: 134.03792 Da
Monoisotopic Mass: 0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	135.045196	122.9
[M+Na]+	157.027138	130.9
[M-H]-	133.030644	122.3
[M+NH4]+	152.071743	144.9
[M+K]+	173.001078	131.7
[M+H-H2O]+	117.035180	117.8
[M+HCOO]-	179.036121	145.3
[M+CH3COO]-	193.051771	171.3
[M+Na-2H]-	155.012586	127.6
[M]+	134.03737142	124.2
[M]-	134.03846858	124.2

Literature stripe

literature stripe

Patent stripe

patents stripe