CID 19023731

2,2-difluoro-n-methoxy-n-methylacetamide

Structural Information

Molecular Formula
C4H7F2NO2
SMILES
CN(C(=O)C(F)F)OC
InChI
InChI=1S/C4H7F2NO2/c1-7(9-2)4(8)3(5)6/h3H,1-2H3
InChIKey
CUPRFYMJGQMIIC-UHFFFAOYSA-N
Compound name
2,2-difluoro-N-methoxy-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

139.04448 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.051756 123.5
[M+Na]+ 162.033698 130.8
[M-H]- 138.037204 122.9
[M+NH4]+ 157.078303 145.3
[M+K]+ 178.007638 132.8
[M+H-H2O]+ 122.041740 116.8
[M+HCOO]- 184.042681 146.0
[M+CH3COO]- 198.058331 179.1
[M+Na-2H]- 160.019146 127.4
[M]+ 139.04393142 122.8
[M]- 139.04502858 122.8
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