CID 482398

(2r)-n,2-dibenzyl-n-benzyloxy-4-oxo-azetidine-1-carboxamide

Structural Information

Molecular Formula
C25H24N2O3
SMILES
C1[C@H](N(C1=O)C(=O)N(CC2=CC=CC=C2)OCC3=CC=CC=C3)CC4=CC=CC=C4
InChI
InChI=1S/C25H24N2O3/c28-24-17-23(16-20-10-4-1-5-11-20)27(24)25(29)26(18-21-12-6-2-7-13-21)30-19-22-14-8-3-9-15-22/h1-15,23H,16-19H2/t23-/m1/s1
InChIKey
SQHAXPYIFQIFIM-HSZRJFAPSA-N
Compound name
(2R)-N,2-dibenzyl-4-oxo-N-phenylmethoxyazetidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

400.17868 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.18596 195.6
[M+Na]+ 423.16790 197.8
[M-H]- 399.17140 206.1
[M+NH4]+ 418.21250 197.6
[M+K]+ 439.14184 196.9
[M+H-H2O]+ 383.17594 177.4
[M+HCOO]- 445.17688 215.2
[M+CH3COO]- 459.19253 228.2
[M+Na-2H]- 421.15335 196.7
[M]+ 400.17813 204.5
[M]- 400.17923 204.5
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

No patent data available for this compound.