CID 21639910

2,2-difluoropropanamide

Structural Information

Molecular Formula
C3H5F2NO
SMILES
CC(C(=O)N)(F)F
InChI
InChI=1S/C3H5F2NO/c1-3(4,5)2(6)7/h1H3,(H2,6,7)
InChIKey
XJGBNZRVGOENRN-UHFFFAOYSA-N
Compound name
2,2-difluoropropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

413
Patents

109.03392 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.041196 115.8
[M+Na]+ 132.023138 123.9
[M-H]- 108.026644 113.6
[M+NH4]+ 127.067743 138.1
[M+K]+ 147.997078 123.9
[M+H-H2O]+ 92.031180 110.3
[M+HCOO]- 154.032121 136.7
[M+CH3COO]- 168.047771 169.8
[M+Na-2H]- 130.008586 121.8
[M]+ 109.03337142 111.2
[M]- 109.03446858 111.2
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