CID 2822962

Hms1666k05

Structural Information

Molecular Formula
C20H23N3O2
SMILES
C1CC(NC1C(=O)NCC2=CC=CC=C2)C(=O)NCC3=CC=CC=C3
InChI
InChI=1S/C20H23N3O2/c24-19(21-13-15-7-3-1-4-8-15)17-11-12-18(23-17)20(25)22-14-16-9-5-2-6-10-16/h1-10,17-18,23H,11-14H2,(H,21,24)(H,22,25)
InChIKey
OAUYSAAGFIBUQU-UHFFFAOYSA-N
Compound name
2-N,5-N-dibenzylpyrrolidine-2,5-dicarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

337.17902 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.186296 179.8
[M+Na]+ 360.168238 181.4
[M-H]- 336.171744 185.7
[M+NH4]+ 355.212843 191.3
[M+K]+ 376.142178 176.2
[M+H-H2O]+ 320.176280 170.0
[M+HCOO]- 382.177221 199.5
[M+CH3COO]- 396.192871 210.7
[M+Na-2H]- 358.153686 180.4
[M]+ 337.17847142 174.0
[M]- 337.17956858 174.0
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.