CID 6432632

2,2-difluoro-n,n-dimethylacetamide

Structural Information

Molecular Formula
C4H7F2NO
SMILES
CN(C)C(=O)C(F)F
InChI
InChI=1S/C4H7F2NO/c1-7(2)4(8)3(5)6/h3H,1-2H3
InChIKey
IUEWOPMXNADAEB-UHFFFAOYSA-N
Compound name
2,2-difluoro-N,N-dimethylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

123.04957 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.056846 120.5
[M+Na]+ 146.038788 127.9
[M-H]- 122.042294 120.0
[M+NH4]+ 141.083393 143.1
[M+K]+ 162.012728 129.5
[M+H-H2O]+ 106.046830 114.1
[M+HCOO]- 168.047771 142.9
[M+CH3COO]- 182.063421 177.1
[M+Na-2H]- 144.024236 124.5
[M]+ 123.04902142 118.4
[M]- 123.05011858 118.4
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