CID 482376

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

Structural Information

Molecular Formula
C18H18N2O2
SMILES
C1[C@H](N(C1=O)C(=O)NCC2=CC=CC=C2)CC3=CC=CC=C3
InChI
InChI=1S/C18H18N2O2/c21-17-12-16(11-14-7-3-1-4-8-14)20(17)18(22)19-13-15-9-5-2-6-10-15/h1-10,16H,11-13H2,(H,19,22)/t16-/m1/s1
InChIKey
DJTULQZWVZEGBV-MRXNPFEDSA-N
Compound name
(2R)-N,2-dibenzyl-4-oxoazetidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

294.13684 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.14412 167.8
[M+Na]+ 317.12606 172.2
[M-H]- 293.12956 175.3
[M+NH4]+ 312.17066 174.6
[M+K]+ 333.10000 171.1
[M+H-H2O]+ 277.13410 152.6
[M+HCOO]- 339.13504 188.4
[M+CH3COO]- 353.15069 206.8
[M+Na-2H]- 315.11151 171.0
[M]+ 294.13629 175.0
[M]- 294.13739 175.0
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.