CID 2826181

Maybridge4_002880

Structural Information

Molecular Formula
C19H20N2O2
SMILES
CC(C)C1=CC=C(C=C1)NN2C(=O)CC(C2=O)C3=CC=CC=C3
InChI
InChI=1S/C19H20N2O2/c1-13(2)14-8-10-16(11-9-14)20-21-18(22)12-17(19(21)23)15-6-4-3-5-7-15/h3-11,13,17,20H,12H2,1-2H3
InChIKey
YLZARTZXPIEESK-UHFFFAOYSA-N
Compound name
3-phenyl-1-(4-propan-2-ylanilino)pyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

308.15247 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.159746 172.9
[M+Na]+ 331.141688 179.4
[M-H]- 307.145194 181.6
[M+NH4]+ 326.186293 187.6
[M+K]+ 347.115628 174.6
[M+H-H2O]+ 291.149730 163.9
[M+HCOO]- 353.150671 194.4
[M+CH3COO]- 367.166321 209.0
[M+Na-2H]- 329.127136 172.6
[M]+ 308.15192142 171.3
[M]- 308.15301858 171.3
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.