CID 2798712

N-[4-(oxiran-2-ylmethoxy)phenyl]acetamide

Structural Information

Molecular Formula
C11H13NO3
SMILES
CC(=O)NC1=CC=C(C=C1)OCC2CO2
InChI
InChI=1S/C11H13NO3/c1-8(13)12-9-2-4-10(5-3-9)14-6-11-7-15-11/h2-5,11H,6-7H2,1H3,(H,12,13)
InChIKey
OQAKYHCGYGLHAZ-UHFFFAOYSA-N
Compound name
N-[4-(oxiran-2-ylmethoxy)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

79
Patents

207.08954 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 146.3
[M+Na]+ 230.07876 159.3
[M+NH4]+ 225.12336 154.6
[M+K]+ 246.05270 155.4
[M-H]- 206.08226 157.5
[M+Na-2H]- 228.06421 155.3
[M]+ 207.08899 152.3
[M]- 207.09009 152.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe