CID 9578761

1-(benzofuran-2-yl)-n-methoxy-1-phenyl-methanimine

Structural Information

Molecular Formula
C16H13NO2
SMILES
CO/N=C(\C1=CC=CC=C1)/C2=CC3=CC=CC=C3O2
InChI
InChI=1S/C16H13NO2/c1-18-17-16(12-7-3-2-4-8-12)15-11-13-9-5-6-10-14(13)19-15/h2-11H,1H3/b17-16+
InChIKey
QMBUIFRXQQICPY-WUKNDPDISA-N
Compound name
(E)-1-(1-benzofuran-2-yl)-N-methoxy-1-phenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

251.09464 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 252.101916 155.0
[M+Na]+ 274.083858 163.7
[M-H]- 250.087364 165.2
[M+NH4]+ 269.128463 173.8
[M+K]+ 290.057798 161.5
[M+H-H2O]+ 234.091900 147.5
[M+HCOO]- 296.092841 182.0
[M+CH3COO]- 310.108491 169.1
[M+Na-2H]- 272.069306 163.0
[M]+ 251.09409142 159.4
[M]- 251.09518858 159.4
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.