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]+ 200.08815 139.7
[M+Na]+ 222.07009 148.3
[M-H]- 198.07359 140.9
[M+NH4]+ 217.11469 158.9
[M+K]+ 238.04403 145.7
[M+H-H2O]+ 182.07813 132.8
[M+HCOO]- 244.07907 160.1
[M+CH3COO]- 258.09472 188.6
[M+Na-2H]- 220.05554 143.5
[M]+ 199.08032 136.2
[M]- 199.08142 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.