CID 340121

82918-98-7

Structural Information

Molecular Formula
C12H15NO2
SMILES
CC1(C(N(C1=O)C)C2=CC=CC=C2)OC
InChI
InChI=1S/C12H15NO2/c1-12(15-3)10(13(2)11(12)14)9-7-5-4-6-8-9/h4-8,10H,1-3H3
InChIKey
WOOVUBIJEITYNW-UHFFFAOYSA-N
Compound name
3-methoxy-1,3-dimethyl-4-phenylazetidin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.11028 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.11756 142.0
[M+Na]+ 228.09950 150.5
[M-H]- 204.10300 148.1
[M+NH4]+ 223.14410 155.9
[M+K]+ 244.07344 151.5
[M+H-H2O]+ 188.10754 131.2
[M+HCOO]- 250.10848 163.2
[M+CH3COO]- 264.12413 190.5
[M+Na-2H]- 226.08495 147.4
[M]+ 205.10973 152.9
[M]- 205.11083 152.9
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.