CID 68215

N-phenylphthalimide

Structural Information

Molecular Formula
C14H9NO2
SMILES
C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C14H9NO2/c16-13-11-8-4-5-9-12(11)14(17)15(13)10-6-2-1-3-7-10/h1-9H
InChIKey
MFUPLJQNEXUUDW-UHFFFAOYSA-N
Compound name
2-phenylisoindole-1,3-dione
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

31
References

3944
Patents

223.06332 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.07060 147.8
[M+Na]+ 246.05254 162.9
[M+NH4]+ 241.09714 156.9
[M+K]+ 262.02648 156.8
[M-H]- 222.05604 151.8
[M+Na-2H]- 244.03799 155.9
[M]+ 223.06277 151.1
[M]- 223.06387 151.1
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

patents stripe