CID 26985446

1210255-19-8

Structural Information

Molecular Formula
C8H7F2NO
SMILES
C1=CC(=C(C(=C1)F)C(=O)CN)F
InChI
InChI=1S/C8H7F2NO/c9-5-2-1-3-6(10)8(5)7(12)4-11/h1-3H,4,11H2
InChIKey
CLJFCMPUSKIUHO-UHFFFAOYSA-N
Compound name
2-amino-1-(2,6-difluorophenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

171.04958 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.05686 130.7
[M+Na]+ 194.03880 139.7
[M-H]- 170.04230 131.9
[M+NH4]+ 189.08340 150.8
[M+K]+ 210.01274 137.1
[M+H-H2O]+ 154.04684 123.5
[M+HCOO]- 216.04778 153.3
[M+CH3COO]- 230.06343 182.2
[M+Na-2H]- 192.02425 134.8
[M]+ 171.04903 127.0
[M]- 171.05013 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

No patent data available for this compound.