CID 97891

1,4-diphenyl-2-azetidinone

Structural Information

Molecular Formula
C15H13NO
SMILES
C1C(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C15H13NO/c17-15-11-14(12-7-3-1-4-8-12)16(15)13-9-5-2-6-10-13/h1-10,14H,11H2
InChIKey
HZVHFGGPXITZGN-UHFFFAOYSA-N
Compound name
1,4-diphenylazetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

177
Patents

223.09972 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.10700 144.1
[M+Na]+ 246.08894 151.3
[M-H]- 222.09244 152.3
[M+NH4]+ 241.13354 154.5
[M+K]+ 262.06288 150.1
[M+H-H2O]+ 206.09698 130.7
[M+HCOO]- 268.09792 165.6
[M+CH3COO]- 282.11357 192.5
[M+Na-2H]- 244.07439 150.3
[M]+ 223.09917 151.3
[M]- 223.10027 151.3
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.