CID 492278

6-chloro-2-phenyl-4-quinaldyl-3-iminophenol

Structural Information

Molecular Formula
C21H15ClN2O
SMILES
C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)NC4=CC(=CC=C4)O
InChI
InChI=1S/C21H15ClN2O/c22-15-9-10-19-18(11-15)21(23-16-7-4-8-17(25)12-16)13-20(24-19)14-5-2-1-3-6-14/h1-13,25H,(H,23,24)
InChIKey
JODMBGZOHBWAFP-UHFFFAOYSA-N
Compound name
3-[(6-chloro-2-phenylquinolin-4-yl)amino]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.08728 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.09456 180.2
[M+Na]+ 369.07650 189.5
[M-H]- 345.08000 188.1
[M+NH4]+ 364.12110 192.6
[M+K]+ 385.05044 180.8
[M+H-H2O]+ 329.08454 170.5
[M+HCOO]- 391.08548 196.8
[M+CH3COO]- 405.10113 190.6
[M+Na-2H]- 367.06195 186.7
[M]+ 346.08673 181.1
[M]- 346.08783 181.1
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.