CID 482396

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

Structural Information

Molecular Formula
C21H22N2O2
SMILES
C1CC1N(CC2=CC=CC=C2)C(=O)N3[C@@H](CC3=O)CC4=CC=CC=C4
InChI
InChI=1S/C21H22N2O2/c24-20-14-19(13-16-7-3-1-4-8-16)23(20)21(25)22(18-11-12-18)15-17-9-5-2-6-10-17/h1-10,18-19H,11-15H2/t19-/m1/s1
InChIKey
CJDUZWWQKKNONW-LJQANCHMSA-N
Compound name
(2R)-N,2-dibenzyl-N-cyclopropyl-4-oxoazetidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

334.16812 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.17540 176.4
[M+Na]+ 357.15734 181.3
[M-H]- 333.16084 187.9
[M+NH4]+ 352.20194 177.9
[M+K]+ 373.13128 180.4
[M+H-H2O]+ 317.16538 161.0
[M+HCOO]- 379.16632 197.2
[M+CH3COO]- 393.18197 218.9
[M+Na-2H]- 355.14279 177.9
[M]+ 334.16757 186.2
[M]- 334.16867 186.2
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.