CID 351268

1-(4-chlorophenyl)-4-phenylazetidin-2-one

Structural Information

Molecular Formula
C15H12ClNO
SMILES
C1C(N(C1=O)C2=CC=C(C=C2)Cl)C3=CC=CC=C3
InChI
InChI=1S/C15H12ClNO/c16-12-6-8-13(9-7-12)17-14(10-15(17)18)11-4-2-1-3-5-11/h1-9,14H,10H2
InChIKey
LXZBKYRWRVPJBC-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-4-phenylazetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.06073 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.06801 148.9
[M+Na]+ 280.04995 161.7
[M+NH4]+ 275.09455 154.8
[M+K]+ 296.02389 154.8
[M-H]- 256.05345 152.4
[M+Na-2H]- 278.03540 157.7
[M]+ 257.06018 151.1
[M]- 257.06128 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

No patent data available for this compound.