CID 10084540

Schembl2840402

Structural Information

Molecular Formula
C15H13NO4
SMILES
CNC(=O)C1=C(OC2=C1C=C(C=C2)OC)C3=COC=C3
InChI
InChI=1S/C15H13NO4/c1-16-15(17)13-11-7-10(18-2)3-4-12(11)20-14(13)9-5-6-19-8-9/h3-8H,1-2H3,(H,16,17)
InChIKey
OOGUDHOYJKBIFW-UHFFFAOYSA-N
Compound name
2-(furan-3-yl)-5-methoxy-N-methyl-1-benzofuran-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

271.08447 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 272.09175 158.9
[M+Na]+ 294.07369 169.0
[M-H]- 270.07719 169.5
[M+NH4]+ 289.11829 177.2
[M+K]+ 310.04763 168.6
[M+H-H2O]+ 254.08173 153.5
[M+HCOO]- 316.08267 184.9
[M+CH3COO]- 330.09832 198.8
[M+Na-2H]- 292.05914 164.0
[M]+ 271.08392 166.3
[M]- 271.08502 166.3
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