CID 4219755

97078-73-4

Structural Information

Molecular Formula
C19H20N4O3
SMILES
CN(C)CC(=O)NC1C(=O)N(N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3
InChI
InChI=1S/C19H20N4O3/c1-21(2)13-16(24)20-17-18(25)22(14-9-5-3-6-10-14)23(19(17)26)15-11-7-4-8-12-15/h3-12,17H,13H2,1-2H3,(H,20,24)
InChIKey
FLCJMAVUIQLFTE-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-N-(3,5-dioxo-1,2-diphenylpyrazolidin-4-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

352.15353 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.16081 182.5
[M+Na]+ 375.14275 188.2
[M-H]- 351.14625 191.2
[M+NH4]+ 370.18735 194.1
[M+K]+ 391.11669 184.7
[M+H-H2O]+ 335.15079 172.0
[M+HCOO]- 397.15173 204.5
[M+CH3COO]- 411.16738 221.0
[M+Na-2H]- 373.12820 182.4
[M]+ 352.15298 182.6
[M]- 352.15408 182.6
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.