CID 58736313

2,2-difluoro-n-methoxy-n-methylpropanamide

Structural Information

Molecular Formula
C5H9F2NO2
SMILES
CC(C(=O)N(C)OC)(F)F
InChI
InChI=1S/C5H9F2NO2/c1-5(6,7)4(9)8(2)10-3/h1-3H3
InChIKey
IOFFSZHUEANECU-UHFFFAOYSA-N
Compound name
2,2-difluoro-N-methoxy-N-methylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

153.06013 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.06741 127.1
[M+Na]+ 176.04935 134.7
[M-H]- 152.05285 126.6
[M+NH4]+ 171.09395 148.6
[M+K]+ 192.02329 136.4
[M+H-H2O]+ 136.05739 120.9
[M+HCOO]- 198.05833 148.8
[M+CH3COO]- 212.07398 181.5
[M+Na-2H]- 174.03480 132.5
[M]+ 153.05958 127.0
[M]- 153.06068 127.0
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