CID 238034

2-(4-aminophenyl)acetamide

Structural Information

Molecular Formula
C8H10N2O
SMILES
C1=CC(=CC=C1CC(=O)N)N
InChI
InChI=1S/C8H10N2O/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4H,5,9H2,(H2,10,11)
InChIKey
PBFBGLBYZHLKHL-UHFFFAOYSA-N
Compound name
2-(4-aminophenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

454
Patents

150.07932 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08660 130.5
[M+Na]+ 173.06854 137.5
[M-H]- 149.07204 133.5
[M+NH4]+ 168.11314 150.6
[M+K]+ 189.04248 135.5
[M+H-H2O]+ 133.07658 124.5
[M+HCOO]- 195.07752 155.6
[M+CH3COO]- 209.09317 179.9
[M+Na-2H]- 171.05399 135.6
[M]+ 150.07877 126.9
[M]- 150.07987 126.9
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