CID 58604

101651-51-8

Structural Information

Molecular Formula
C13H16N2O3
SMILES
CC(=O)NC1=CC(=C(C=C1)OCC=C)NC(=O)C
InChI
InChI=1S/C13H16N2O3/c1-4-7-18-13-6-5-11(14-9(2)16)8-12(13)15-10(3)17/h4-6,8H,1,7H2,2-3H3,(H,14,16)(H,15,17)
InChIKey
KSNKVPBPDATKHR-UHFFFAOYSA-N
Compound name
N-(3-acetamido-4-prop-2-enoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

248.11609 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.12337 156.4
[M+Na]+ 271.10531 162.5
[M-H]- 247.10881 160.1
[M+NH4]+ 266.14991 173.2
[M+K]+ 287.07925 160.4
[M+H-H2O]+ 231.11335 149.4
[M+HCOO]- 293.11429 180.9
[M+CH3COO]- 307.12994 199.7
[M+Na-2H]- 269.09076 159.2
[M]+ 248.11554 157.8
[M]- 248.11664 157.8
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.