CID 151075

Nepafenac

Structural Information

Molecular Formula
C15H14N2O2
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=CC(=C2N)CC(=O)N
InChI
InChI=1S/C15H14N2O2/c16-13(18)9-11-7-4-8-12(14(11)17)15(19)10-5-2-1-3-6-10/h1-8H,9,17H2,(H2,16,18)
InChIKey
QEFAQIPZVLVERP-UHFFFAOYSA-N
Compound name
2-(2-amino-3-benzoylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

205
References

7838
Patents

254.10553 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 255.11281 158.1
[M+Na]+ 277.09475 164.3
[M-H]- 253.09825 164.1
[M+NH4]+ 272.13935 173.6
[M+K]+ 293.06869 160.5
[M+H-H2O]+ 237.10279 150.3
[M+HCOO]- 299.10373 181.8
[M+CH3COO]- 313.11938 200.4
[M+Na-2H]- 275.08020 160.4
[M]+ 254.10498 155.1
[M]- 254.10608 155.1
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.