CID 22033841

N-(3-aminophenyl)acrylamide

Structural Information

Molecular Formula
C9H10N2O
SMILES
C=CC(=O)NC1=CC=CC(=C1)N
InChI
InChI=1S/C9H10N2O/c1-2-9(12)11-8-5-3-4-7(10)6-8/h2-6H,1,10H2,(H,11,12)
InChIKey
RRKWPXMDCPJEHS-UHFFFAOYSA-N
Compound name
N-(3-aminophenyl)prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

284
Patents

162.07932 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.08660 134.6
[M+Na]+ 185.06854 145.4
[M+NH4]+ 180.11314 142.4
[M+K]+ 201.04248 139.6
[M-H]- 161.07204 137.1
[M+Na-2H]- 183.05399 140.9
[M]+ 162.07877 136.5
[M]- 162.07987 136.5
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

patents stripe