CID 165855602

1-(4-amino-2-ethoxyphenyl)-3,3-dimethylazetidin-2-one

Structural Information

Molecular Formula
C13H18N2O2
SMILES
CCOC1=C(C=CC(=C1)N)N2CC(C2=O)(C)C
InChI
InChI=1S/C13H18N2O2/c1-4-17-11-7-9(14)5-6-10(11)15-8-13(2,3)12(15)16/h5-7H,4,8,14H2,1-3H3
InChIKey
JHSJAVHJAZMBPL-UHFFFAOYSA-N
Compound name
1-(4-amino-2-ethoxyphenyl)-3,3-dimethylazetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.13683 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.14411 155.0
[M+Na]+ 257.12605 162.6
[M+NH4]+ 252.17065 159.6
[M+K]+ 273.09999 156.8
[M-H]- 233.12955 155.1
[M+Na-2H]- 255.11150 159.5
[M]+ 234.13628 155.0
[M]- 234.13738 155.0
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.