CID 43458374

N-[(2-aminophenyl)methyl]-n-methyl-1-benzofuran-2-carboxamide

Structural Information

Molecular Formula
C17H16N2O2
SMILES
CN(CC1=CC=CC=C1N)C(=O)C2=CC3=CC=CC=C3O2
InChI
InChI=1S/C17H16N2O2/c1-19(11-13-7-2-4-8-14(13)18)17(20)16-10-12-6-3-5-9-15(12)21-16/h2-10H,11,18H2,1H3
InChIKey
XSRAOBHHWPYBSE-UHFFFAOYSA-N
Compound name
N-[(2-aminophenyl)methyl]-N-methyl-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

280.1212 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.12848 165.0
[M+Na]+ 303.11042 172.9
[M-H]- 279.11392 174.8
[M+NH4]+ 298.15502 182.1
[M+K]+ 319.08436 170.6
[M+H-H2O]+ 263.11846 157.2
[M+HCOO]- 325.11940 190.9
[M+CH3COO]- 339.13505 206.8
[M+Na-2H]- 301.09587 170.0
[M]+ 280.12065 167.8
[M]- 280.12175 167.8
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.