CID 482379

(2r)-2-benzyl-4-oxo-n-phenethyl-azetidine-1-carboxamide

Structural Information

Molecular Formula
C19H20N2O2
SMILES
C1[C@H](N(C1=O)C(=O)NCCC2=CC=CC=C2)CC3=CC=CC=C3
InChI
InChI=1S/C19H20N2O2/c22-18-14-17(13-16-9-5-2-6-10-16)21(18)19(23)20-12-11-15-7-3-1-4-8-15/h1-10,17H,11-14H2,(H,20,23)/t17-/m1/s1
InChIKey
NVQYETKLHIBPLH-QGZVFWFLSA-N
Compound name
(2R)-2-benzyl-4-oxo-N-(2-phenylethyl)azetidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

308.15247 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.15975 172.4
[M+Na]+ 331.14169 176.3
[M-H]- 307.14519 179.6
[M+NH4]+ 326.18629 178.6
[M+K]+ 347.11563 175.0
[M+H-H2O]+ 291.14973 156.9
[M+HCOO]- 353.15067 192.6
[M+CH3COO]- 367.16632 209.7
[M+Na-2H]- 329.12714 175.1
[M]+ 308.15192 179.9
[M]- 308.15302 179.9
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.