CID 10333958

Schembl2840378

Structural Information

Molecular Formula
C16H14N2O3
SMILES
CNC(=O)C1=C(OC2=C1C=C(C=C2)OC)C3=CC=NC=C3
InChI
InChI=1S/C16H14N2O3/c1-17-16(19)14-12-9-11(20-2)3-4-13(12)21-15(14)10-5-7-18-8-6-10/h3-9H,1-2H3,(H,17,19)
InChIKey
GMPCQPOKQKTSBJ-UHFFFAOYSA-N
Compound name
5-methoxy-N-methyl-2-pyridin-4-yl-1-benzofuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

282.10043 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.10771 162.8
[M+Na]+ 305.08965 172.7
[M-H]- 281.09315 171.0
[M+NH4]+ 300.13425 178.8
[M+K]+ 321.06359 170.1
[M+H-H2O]+ 265.09769 154.8
[M+HCOO]- 327.09863 187.2
[M+CH3COO]- 341.11428 176.0
[M+Na-2H]- 303.07510 169.0
[M]+ 282.09988 168.1
[M]- 282.10098 168.1
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