CID 966649

4-iodo-n-(4-methoxybenzylidene)aniline

Structural Information

Molecular Formula
C14H12INO
SMILES
COC1=CC=C(C=C1)C=NC2=CC=C(C=C2)I
InChI
InChI=1S/C14H12INO/c1-17-14-8-2-11(3-9-14)10-16-13-6-4-12(15)5-7-13/h2-10H,1H3
InChIKey
KYXOANCXPAQAGL-UHFFFAOYSA-N
Compound name
N-(4-iodophenyl)-1-(4-methoxyphenyl)methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

336.99637 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.00365 163.7
[M+Na]+ 359.98559 170.9
[M+NH4]+ 355.03019 168.6
[M+K]+ 375.95953 165.2
[M-H]- 335.98909 163.2
[M+Na-2H]- 357.97104 161.0
[M]+ 336.99582 163.7
[M]- 336.99692 163.7
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

patents stripe