CID 47003263

2-(3-fluorophenyl)-2-(methylamino)acetamide

Structural Information

Molecular Formula
C9H11FN2O
SMILES
CNC(C1=CC(=CC=C1)F)C(=O)N
InChI
InChI=1S/C9H11FN2O/c1-12-8(9(11)13)6-3-2-4-7(10)5-6/h2-5,8,12H,1H3,(H2,11,13)
InChIKey
OTRJWFIPDLSIIB-UHFFFAOYSA-N
Compound name
2-(3-fluorophenyl)-2-(methylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

182.08554 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.09282 137.8
[M+Na]+ 205.07476 144.1
[M-H]- 181.07826 139.7
[M+NH4]+ 200.11936 156.7
[M+K]+ 221.04870 142.2
[M+H-H2O]+ 165.08280 130.6
[M+HCOO]- 227.08374 161.1
[M+CH3COO]- 241.09939 187.2
[M+Na-2H]- 203.06021 141.6
[M]+ 182.08499 133.8
[M]- 182.08609 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

patents stripe