CID 9652051

2-(2,3-dichlorophenoxy)-n'-{(e)-[3-(4-methylphenyl)-1-phenyl-1h-pyrazol-4-yl]methylidene}acetohydrazide

Structural Information

Molecular Formula
C25H20Cl2N4O2
SMILES
CC1=CC=C(C=C1)C2=NN(C=C2/C=N/NC(=O)COC3=C(C(=CC=C3)Cl)Cl)C4=CC=CC=C4
InChI
InChI=1S/C25H20Cl2N4O2/c1-17-10-12-18(13-11-17)25-19(15-31(30-25)20-6-3-2-4-7-20)14-28-29-23(32)16-33-22-9-5-8-21(26)24(22)27/h2-15H,16H2,1H3,(H,29,32)/b28-14+
InChIKey
QWNOLQRDZRGSCP-CCVNUDIWSA-N
Compound name
2-(2,3-dichlorophenoxy)-N-[(E)-[3-(4-methylphenyl)-1-phenylpyrazol-4-yl]methylideneamino]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

478.09634 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 479.10362 215.5
[M+Na]+ 501.08556 223.8
[M-H]- 477.08906 226.2
[M+NH4]+ 496.13016 223.2
[M+K]+ 517.05950 215.3
[M+H-H2O]+ 461.09360 203.3
[M+HCOO]- 523.09454 229.9
[M+CH3COO]- 537.11019 223.8
[M+Na-2H]- 499.07101 215.0
[M]+ 478.09579 221.7
[M]- 478.09689 221.7
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.