CID 923439

3,4-dimethoxycinnamamide

Structural Information

Molecular Formula
C11H13NO3
SMILES
COC1=C(C=C(C=C1)/C=C/C(=O)N)OC
InChI
InChI=1S/C11H13NO3/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3-7H,1-2H3,(H2,12,13)/b6-4+
InChIKey
QUKZILHYXHKAKT-GQCTYLIASA-N
Compound name
(E)-3-(3,4-dimethoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

14
Patents

207.08954 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.09682 144.3
[M+Na]+ 230.07876 152.1
[M-H]- 206.08226 147.8
[M+NH4]+ 225.12336 163.0
[M+K]+ 246.05270 150.2
[M+H-H2O]+ 190.08680 138.0
[M+HCOO]- 252.08774 168.7
[M+CH3COO]- 266.10339 188.5
[M+Na-2H]- 228.06421 148.0
[M]+ 207.08899 146.1
[M]- 207.09009 146.1
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