CID 9604759

1-(4-chlorophenyl)-n-[(4-chlorophenyl)methoxy]-1-(3-methylbenzofuran-2-yl)methanimine

Structural Information

Molecular Formula
C23H17Cl2NO2
SMILES
CC1=C(OC2=CC=CC=C12)/C(=N/OCC3=CC=C(C=C3)Cl)/C4=CC=C(C=C4)Cl
InChI
InChI=1S/C23H17Cl2NO2/c1-15-20-4-2-3-5-21(20)28-23(15)22(17-8-12-19(25)13-9-17)26-27-14-16-6-10-18(24)11-7-16/h2-13H,14H2,1H3/b26-22+
InChIKey
DGRYPNICRXEKBW-XTCLZLMSSA-N
Compound name
(E)-1-(4-chlorophenyl)-N-[(4-chlorophenyl)methoxy]-1-(3-methyl-1-benzofuran-2-yl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

409.06363 Da
Monoisotopic Mass

7.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 410.07091 199.6
[M+Na]+ 432.05285 210.3
[M-H]- 408.05635 211.7
[M+NH4]+ 427.09745 213.4
[M+K]+ 448.02679 203.5
[M+H-H2O]+ 392.06089 191.1
[M+HCOO]- 454.06183 215.2
[M+CH3COO]- 468.07748 210.8
[M+Na-2H]- 430.03830 201.7
[M]+ 409.06308 208.7
[M]- 409.06418 208.7
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.