CID 217797

Brn 0436912

Structural Information

Molecular Formula
C17H26N4O2
SMILES
CCN(CC)CCNC(=O)C1CC(=O)N(C1)NC2=CC=CC=C2
InChI
InChI=1S/C17H26N4O2/c1-3-20(4-2)11-10-18-17(23)14-12-16(22)21(13-14)19-15-8-6-5-7-9-15/h5-9,14,19H,3-4,10-13H2,1-2H3,(H,18,23)
InChIKey
YAXKFFMOFPWBFZ-UHFFFAOYSA-N
Compound name
1-anilino-N-[2-(diethylamino)ethyl]-5-oxopyrrolidine-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

318.20557 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 319.212846 176.9
[M+Na]+ 341.194788 179.4
[M-H]- 317.198294 182.7
[M+NH4]+ 336.239393 191.0
[M+K]+ 357.168728 177.2
[M+H-H2O]+ 301.202830 167.4
[M+HCOO]- 363.203771 200.3
[M+CH3COO]- 377.219421 217.6
[M+Na-2H]- 339.180236 177.3
[M]+ 318.20502142 176.1
[M]- 318.20611858 176.1
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.