CID 9575782

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

Structural Information

Molecular Formula
C20H13ClF2N2O2
SMILES
C1=CC(=CC=C1/C=N/NC(=O)C2=C(C=CC(=C2)C3=C(C=C(C=C3)F)F)O)Cl
InChI
InChI=1S/C20H13ClF2N2O2/c21-14-4-1-12(2-5-14)11-24-25-20(27)17-9-13(3-8-19(17)26)16-7-6-15(22)10-18(16)23/h1-11,26H,(H,25,27)/b24-11+
InChIKey
MWEPEQQVLIDISI-BHGWPJFGSA-N
Compound name
N-[(E)-(4-chlorophenyl)methylideneamino]-5-(2,4-difluorophenyl)-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

386.06335 Da
Monoisotopic Mass

6.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.07063 187.8
[M+Na]+ 409.05257 197.2
[M-H]- 385.05607 195.4
[M+NH4]+ 404.09717 199.7
[M+K]+ 425.02651 189.4
[M+H-H2O]+ 369.06061 177.2
[M+HCOO]- 431.06155 206.5
[M+CH3COO]- 445.07720 222.9
[M+Na-2H]- 407.03802 189.3
[M]+ 386.06280 188.1
[M]- 386.06390 188.1
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.