CID 3058234

74767-09-2

Structural Information

Molecular Formula
C25H20N2O3
SMILES
CC1=CC2=C(C=C(N=C2C=C1)C)OC(=O)C3=CC=CC=C3N=CC4=CC=C(C=C4)O
InChI
InChI=1S/C25H20N2O3/c1-16-7-12-23-21(13-16)24(14-17(2)27-23)30-25(29)20-5-3-4-6-22(20)26-15-18-8-10-19(28)11-9-18/h3-15,28H,1-2H3
InChIKey
NVXZNWACUJEJNX-UHFFFAOYSA-N
Compound name
(2,6-dimethylquinolin-4-yl) 2-[(4-hydroxyphenyl)methylideneamino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.1474 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.154676 197.6
[M+Na]+ 419.136618 205.4
[M-H]- 395.140124 207.1
[M+NH4]+ 414.181223 207.6
[M+K]+ 435.110558 199.2
[M+H-H2O]+ 379.144660 186.0
[M+HCOO]- 441.145601 218.4
[M+CH3COO]- 455.161251 207.2
[M+Na-2H]- 417.122066 201.0
[M]+ 396.14685142 199.9
[M]- 396.14794858 199.9
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.