CID 9575790

2', 4'-difluoro-4-hydroxy-biphenyl-3-carboxylic acid (2,4-dichlorobenzylidene) hydrazide

Structural Information

Molecular Formula
C20H12Cl2F2N2O2
SMILES
C1=CC(=C(C=C1C2=C(C=C(C=C2)F)F)C(=O)N/N=C/C3=C(C=C(C=C3)Cl)Cl)O
InChI
InChI=1S/C20H12Cl2F2N2O2/c21-13-3-1-12(17(22)8-13)10-25-26-20(28)16-7-11(2-6-19(16)27)15-5-4-14(23)9-18(15)24/h1-10,27H,(H,26,28)/b25-10+
InChIKey
HMPSJPGJNNGOIR-KIBLKLHPSA-N
Compound name
N-[(E)-(2,4-dichlorophenyl)methylideneamino]-5-(2,4-difluorophenyl)-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

420.02438 Da
Monoisotopic Mass

7.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.03166 193.4
[M+Na]+ 443.01360 204.0
[M-H]- 419.01710 200.5
[M+NH4]+ 438.05820 204.8
[M+K]+ 458.98754 195.4
[M+H-H2O]+ 403.02164 183.8
[M+HCOO]- 465.02258 207.1
[M+CH3COO]- 479.03823 227.9
[M+Na-2H]- 440.99905 193.5
[M]+ 420.02383 195.9
[M]- 420.02493 195.9
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.