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]+ 281.09206 162.0
[M+Na]+ 303.07400 170.0
[M-H]- 279.07750 170.7
[M+NH4]+ 298.11860 178.3
[M+K]+ 319.04794 167.2
[M+H-H2O]+ 263.08204 154.6
[M+HCOO]- 325.08298 187.2
[M+CH3COO]- 339.09863 202.9
[M+Na-2H]- 301.05945 167.3
[M]+ 280.08423 163.4
[M]- 280.08533 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.