CID 211739

23548-48-3

Structural Information

Molecular Formula
C19H28N2O3
SMILES
CCCC1(CC(=O)N(C1=O)CCCN(C)CCO)C2=CC=CC=C2
InChI
InChI=1S/C19H28N2O3/c1-3-10-19(16-8-5-4-6-9-16)15-17(23)21(18(19)24)12-7-11-20(2)13-14-22/h4-6,8-9,22H,3,7,10-15H2,1-2H3
InChIKey
RKGNVPRMLQNKSR-UHFFFAOYSA-N
Compound name
1-[3-[2-hydroxyethyl(methyl)amino]propyl]-3-phenyl-3-propylpyrrolidine-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

332.21 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 333.21728 180.2
[M+Na]+ 355.19922 185.3
[M-H]- 331.20272 184.9
[M+NH4]+ 350.24382 196.2
[M+K]+ 371.17316 182.0
[M+H-H2O]+ 315.20726 172.4
[M+HCOO]- 377.20820 200.5
[M+CH3COO]- 391.22385 213.5
[M+Na-2H]- 353.18467 179.9
[M]+ 332.20945 182.5
[M]- 332.21055 182.5
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.