CID 51060569

881683-69-8

Structural Information

Molecular Formula
C24H18FN5O2
SMILES
C1=CC=C(C=C1)NC(=O)C(=O)N/N=C/C2=CN(N=C2C3=CC=C(C=C3)F)C4=CC=CC=C4
InChI
InChI=1S/C24H18FN5O2/c25-19-13-11-17(12-14-19)22-18(16-30(29-22)21-9-5-2-6-10-21)15-26-28-24(32)23(31)27-20-7-3-1-4-8-20/h1-16H,(H,27,31)(H,28,32)/b26-15+
InChIKey
KPIKFFXIQHBYSB-CVKSISIWSA-N
Compound name
N'-[(E)-[3-(4-fluorophenyl)-1-phenylpyrazol-4-yl]methylideneamino]-N-phenyloxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

427.14444 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 428.15172 201.5
[M+Na]+ 450.13366 213.8
[M+NH4]+ 445.17826 206.5
[M+K]+ 466.10760 207.9
[M-H]- 426.13716 207.9
[M+Na-2H]- 448.11911 212.1
[M]+ 427.14389 204.7
[M]- 427.14499 204.7
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.