CID 9575788

5-(2,4-difluorophenyl)-2-hydroxy-n-[(e)-(2,4,6-trimethylphenyl)methyleneamino]benzamide

Structural Information

Molecular Formula
C23H20F2N2O2
SMILES
CC1=CC(=C(C(=C1)C)/C=N/NC(=O)C2=C(C=CC(=C2)C3=C(C=C(C=C3)F)F)O)C
InChI
InChI=1S/C23H20F2N2O2/c1-13-8-14(2)20(15(3)9-13)12-26-27-23(29)19-10-16(4-7-22(19)28)18-6-5-17(24)11-21(18)25/h4-12,28H,1-3H3,(H,27,29)/b26-12+
InChIKey
ZWDFQGVWPJCPCN-RPPGKUMJSA-N
Compound name
5-(2,4-difluorophenyl)-2-hydroxy-N-[(E)-(2,4,6-trimethylphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

394.1493 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.15658 195.5
[M+Na]+ 417.13852 204.5
[M-H]- 393.14202 203.6
[M+NH4]+ 412.18312 206.7
[M+K]+ 433.11246 197.9
[M+H-H2O]+ 377.14656 183.9
[M+HCOO]- 439.14750 217.5
[M+CH3COO]- 453.16315 230.8
[M+Na-2H]- 415.12397 194.4
[M]+ 394.14875 195.0
[M]- 394.14985 195.0
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.