CID 218731

41242-40-4

Structural Information

Molecular Formula
C21H17NO3
SMILES
COC1=CC(=C(C=C1)C=NC2=CC=CC=C2C(=O)C3=CC=CC=C3)O
InChI
InChI=1S/C21H17NO3/c1-25-17-12-11-16(20(23)13-17)14-22-19-10-6-5-9-18(19)21(24)15-7-3-2-4-8-15/h2-14,23H,1H3
InChIKey
PAOYAPYPVWGSCW-UHFFFAOYSA-N
Compound name
[2-[(2-hydroxy-4-methoxyphenyl)methylideneamino]phenyl]-phenylmethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

331.12085 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 332.12813 179.4
[M+Na]+ 354.11007 195.0
[M+NH4]+ 349.15467 187.2
[M+K]+ 370.08401 186.3
[M-H]- 330.11357 186.4
[M+Na-2H]- 352.09552 190.5
[M]+ 331.12030 183.7
[M]- 331.12140 183.7
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.