CID 10710305

(3-amino-1-benzofuran-2-yl)((1,1'-biphenyl)-4-yl)methanone

Structural Information

Molecular Formula
C21H15NO2
SMILES
C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=C(C4=CC=CC=C4O3)N
InChI
InChI=1S/C21H15NO2/c22-19-17-8-4-5-9-18(17)24-21(19)20(23)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13H,22H2
InChIKey
SEIYYXJTYZUGHJ-UHFFFAOYSA-N
Compound name
(3-amino-1-benzofuran-2-yl)-(4-phenylphenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.1103 Da
Monoisotopic Mass

5.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.11758 173.2
[M+Na]+ 336.09952 182.3
[M-H]- 312.10302 185.0
[M+NH4]+ 331.14412 188.3
[M+K]+ 352.07346 177.4
[M+H-H2O]+ 296.10756 164.9
[M+HCOO]- 358.10850 197.5
[M+CH3COO]- 372.12415 185.7
[M+Na-2H]- 334.08497 177.8
[M]+ 313.10975 174.7
[M]- 313.11085 174.7
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.