CID 9578774

1-(benzofuran-2-yl)-n-[(4-chlorophenyl)methoxy]-1-(4-methoxyphenyl)methanimine

Structural Information

Molecular Formula
C23H18ClNO3
SMILES
COC1=CC=C(C=C1)/C(=N\OCC2=CC=C(C=C2)Cl)/C3=CC4=CC=CC=C4O3
InChI
InChI=1S/C23H18ClNO3/c1-26-20-12-8-17(9-13-20)23(22-14-18-4-2-3-5-21(18)28-22)25-27-15-16-6-10-19(24)11-7-16/h2-14H,15H2,1H3/b25-23+
InChIKey
ATVSOAVVZRGFCW-WJTDDFOZSA-N
Compound name
(E)-1-(1-benzofuran-2-yl)-N-[(4-chlorophenyl)methoxy]-1-(4-methoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

391.09753 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 392.10481 194.3
[M+Na]+ 414.08675 203.6
[M-H]- 390.09025 207.2
[M+NH4]+ 409.13135 208.0
[M+K]+ 430.06069 198.5
[M+H-H2O]+ 374.09479 185.2
[M+HCOO]- 436.09573 215.4
[M+CH3COO]- 450.11138 206.0
[M+Na-2H]- 412.07220 198.4
[M]+ 391.09698 202.9
[M]- 391.09808 202.9
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.