CID 92135239

1951441-46-5

Structural Information

Molecular Formula
C12H16N2O2
SMILES
CC1(CNC1)NC(=O)OCC2=CC=CC=C2
InChI
InChI=1S/C12H16N2O2/c1-12(8-13-9-12)14-11(15)16-7-10-5-3-2-4-6-10/h2-6,13H,7-9H2,1H3,(H,14,15)
InChIKey
CZSJEUANCQDUJL-UHFFFAOYSA-N
Compound name
benzyl N-(3-methylazetidin-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

220.12119 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 221.12847 151.9
[M+Na]+ 243.11041 157.7
[M+NH4]+ 238.15501 156.4
[M+K]+ 259.08435 152.3
[M-H]- 219.11391 151.3
[M+Na-2H]- 241.09586 157.0
[M]+ 220.12064 151.3
[M]- 220.12174 151.3
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.