CID 14227471

116355-49-8

Structural Information

Molecular Formula

C₆H₈F₂O₂

SMILES

CC(=C)C(=O)OCC(F)F

InChI

InChI=1S/C6H8F2O2/c1-4(2)6(9)10-3-5(7)8/h5H,1,3H2,2H3

InChIKey

KZHBCZKGLXRLDW-UHFFFAOYSA-N

Compound name

2,2-difluoroethyl 2-methylprop-2-enoate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 83
Patents: 150.04924 Da
Monoisotopic Mass: 2.1
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]+	151.056516	127.2
[M+Na]+	173.038458	134.5
[M-H]-	149.041964	125.0
[M+NH4]+	168.083063	148.3
[M+K]+	189.012398	134.6
[M+H-H2O]+	133.046500	121.1
[M+HCOO]-	195.047441	146.8
[M+CH3COO]-	209.063091	176.7
[M+Na-2H]-	171.023906	129.5
[M]+	150.04869142	125.5
[M]-	150.04978858	125.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe