CID 281783

2-cyano-3-(3,4-dimethoxyphenyl)acrylamide

Structural Information

Molecular Formula
C12H12N2O3
SMILES
COC1=C(C=C(C=C1)C=C(C#N)C(=O)N)OC
InChI
InChI=1S/C12H12N2O3/c1-16-10-4-3-8(6-11(10)17-2)5-9(7-13)12(14)15/h3-6H,1-2H3,(H2,14,15)
InChIKey
UHGNGGISEFEZHE-UHFFFAOYSA-N
Compound name
2-cyano-3-(3,4-dimethoxyphenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.0848 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.09208 152.8
[M+Na]+ 255.07402 162.5
[M+NH4]+ 250.11862 155.6
[M+K]+ 271.04796 154.9
[M-H]- 231.07752 146.2
[M+Na-2H]- 253.05947 154.4
[M]+ 232.08425 151.2
[M]- 232.08535 151.2
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

No patent data available for this compound.