CID 139022785

1824501-10-1

Structural Information

Molecular Formula
C15H19NO3
SMILES
CC(C)(C)OC(=O)N1CC(=O)C1CC2=CC=CC=C2
InChI
InChI=1S/C15H19NO3/c1-15(2,3)19-14(18)16-10-13(17)12(16)9-11-7-5-4-6-8-11/h4-8,12H,9-10H2,1-3H3
InChIKey
BERNCZJWUMYWDH-UHFFFAOYSA-N
Compound name
tert-butyl 2-benzyl-3-oxoazetidine-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

261.1365 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 262.14378 161.2
[M+Na]+ 284.12572 168.1
[M+NH4]+ 279.17032 163.7
[M+K]+ 300.09966 165.0
[M-H]- 260.12922 159.6
[M+Na-2H]- 282.11117 164.1
[M]+ 261.13595 160.5
[M]- 261.13705 160.5
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

patents stripe