CID 83854588

1402550-75-7

Structural Information

Molecular Formula
C6H5F2NO
SMILES
C1=CC(=O)NC=C1C(F)F
InChI
InChI=1S/C6H5F2NO/c7-6(8)4-1-2-5(10)9-3-4/h1-3,6H,(H,9,10)
InChIKey
HFHSPDOMAZYGRR-UHFFFAOYSA-N
Compound name
5-(difluoromethyl)-1H-pyridin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.03392 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.04120 126.9
[M+Na]+ 168.02314 138.0
[M+NH4]+ 163.06774 133.6
[M+K]+ 183.99708 132.7
[M-H]- 144.02664 124.9
[M+Na-2H]- 166.00859 132.4
[M]+ 145.03337 127.6
[M]- 145.03447 127.6
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

No patent data available for this compound.