CID 3076954

Brn 4814517

Structural Information

Molecular Formula
C15H14N2O3
SMILES
CC1=C(C2=C(O1)C=CC(=C2)OC)C(=O)CN3C=CN=C3
InChI
InChI=1S/C15H14N2O3/c1-10-15(13(18)8-17-6-5-16-9-17)12-7-11(19-2)3-4-14(12)20-10/h3-7,9H,8H2,1-2H3
InChIKey
ORXWSLDGQVRACV-UHFFFAOYSA-N
Compound name
2-imidazol-1-yl-1-(5-methoxy-2-methyl-1-benzofuran-3-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

270.10043 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 271.10771 159.0
[M+Na]+ 293.08965 172.9
[M+NH4]+ 288.13425 166.3
[M+K]+ 309.06359 170.8
[M-H]- 269.09315 162.5
[M+Na-2H]- 291.07510 165.1
[M]+ 270.09988 161.9
[M]- 270.10098 161.9
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.