CID 32588

24664-64-0

Structural Information

Molecular Formula
C24H20N4O2
SMILES
CC(=O)NC1=CC=C(C=C1)N=CC2=C(NN(C2=O)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H20N4O2/c1-17(29)26-20-14-12-19(13-15-20)25-16-22-23(18-8-4-2-5-9-18)27-28(24(22)30)21-10-6-3-7-11-21/h2-16,27H,1H3,(H,26,29)
InChIKey
NABSSQCTERMFBH-UHFFFAOYSA-N
Compound name
N-[4-[(3-oxo-2,5-diphenyl-1H-pyrazol-4-yl)methylideneamino]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

396.15863 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 397.16591 195.1
[M+Na]+ 419.14785 201.9
[M-H]- 395.15135 205.9
[M+NH4]+ 414.19245 203.8
[M+K]+ 435.12179 194.3
[M+H-H2O]+ 379.15589 183.2
[M+HCOO]- 441.15683 218.6
[M+CH3COO]- 455.17248 204.5
[M+Na-2H]- 417.13330 197.2
[M]+ 396.15808 194.3
[M]- 396.15918 194.3
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.