CID 24787

10016-06-5

Structural Information

Molecular Formula
C9H9F2NO
SMILES
CN(C1=CC=C(C=C1)F)C(=O)CF
InChI
InChI=1S/C9H9F2NO/c1-12(9(13)6-10)8-4-2-7(11)3-5-8/h2-5H,6H2,1H3
InChIKey
XMXCIFYSKOQCLE-UHFFFAOYSA-N
Compound name
2-fluoro-N-(4-fluorophenyl)-N-methylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.06522 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.072496 135.3
[M+Na]+ 208.054438 143.1
[M-H]- 184.057944 138.0
[M+NH4]+ 203.099043 155.5
[M+K]+ 224.028378 142.1
[M+H-H2O]+ 168.062480 127.4
[M+HCOO]- 230.063421 158.7
[M+CH3COO]- 244.079071 187.6
[M+Na-2H]- 206.039886 139.9
[M]+ 185.06467142 133.8
[M]- 185.06576858 133.8
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.