CID 717689

N-(4-carbamoylphenyl)-1-benzofuran-2-carboxamide

Structural Information

Molecular Formula
C16H12N2O3
SMILES
C1=CC=C2C(=C1)C=C(O2)C(=O)NC3=CC=C(C=C3)C(=O)N
InChI
InChI=1S/C16H12N2O3/c17-15(19)10-5-7-12(8-6-10)18-16(20)14-9-11-3-1-2-4-13(11)21-14/h1-9H,(H2,17,19)(H,18,20)
InChIKey
KLTMSEYIWNFFOV-UHFFFAOYSA-N
Compound name
N-(4-carbamoylphenyl)-1-benzofuran-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.08478 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.092056 162.0
[M+Na]+ 303.073998 170.0
[M-H]- 279.077504 170.7
[M+NH4]+ 298.118603 178.3
[M+K]+ 319.047938 167.2
[M+H-H2O]+ 263.082040 154.6
[M+HCOO]- 325.082981 187.2
[M+CH3COO]- 339.098631 202.9
[M+Na-2H]- 301.059446 167.3
[M]+ 280.08423142 163.4
[M]- 280.08532858 163.4
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

No patent data available for this compound.