CID 323845

22742-42-3

Structural Information

Molecular Formula
C24H23NO2
SMILES
C1CN(C1C(=O)OCC2=CC=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H23NO2/c26-24(27-18-19-10-4-1-5-11-19)22-16-17-25(22)23(20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15,22-23H,16-18H2
InChIKey
VTDVMKXDAGMXQS-UHFFFAOYSA-N
Compound name
benzyl 1-benzhydrylazetidine-2-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

357.17288 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 358.18016 183.9
[M+Na]+ 380.16210 186.4
[M-H]- 356.16560 193.1
[M+NH4]+ 375.20670 187.4
[M+K]+ 396.13604 184.5
[M+H-H2O]+ 340.17014 167.1
[M+HCOO]- 402.17108 201.3
[M+CH3COO]- 416.18673 216.5
[M+Na-2H]- 378.14755 185.5
[M]+ 357.17233 190.5
[M]- 357.17343 190.5
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.