CID 82397959

2445786-90-1

Structural Information

Molecular Formula
C10H11F2NO
SMILES
CC(C)(C(=O)C1=C(C=C(C=C1)F)F)N
InChI
InChI=1S/C10H11F2NO/c1-10(2,13)9(14)7-4-3-6(11)5-8(7)12/h3-5H,13H2,1-2H3
InChIKey
BKHZJPNODNUASI-UHFFFAOYSA-N
Compound name
2-amino-1-(2,4-difluorophenyl)-2-methylpropan-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

199.08087 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 200.088146 139.7
[M+Na]+ 222.070088 148.3
[M-H]- 198.073594 140.9
[M+NH4]+ 217.114693 158.9
[M+K]+ 238.044028 145.7
[M+H-H2O]+ 182.078130 132.8
[M+HCOO]- 244.079071 160.1
[M+CH3COO]- 258.094721 188.6
[M+Na-2H]- 220.055536 143.5
[M]+ 199.08032142 136.2
[M]- 199.08141858 136.2
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.