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

202
References

8446
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 158.8
[M+Na]+ 277.09475 170.5
[M+NH4]+ 272.13935 166.0
[M+K]+ 293.06869 164.7
[M-H]- 253.09825 163.2
[M+Na-2H]- 275.08020 166.3
[M]+ 254.10498 161.5
[M]- 254.10608 161.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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