CID 93740

51959-92-3

Structural Information

Molecular Formula
C16H20N2O3
SMILES
CCN(CC)C(=O)C1CCC(=O)N1C(=O)C2=CC=CC=C2
InChI
InChI=1S/C16H20N2O3/c1-3-17(4-2)16(21)13-10-11-14(19)18(13)15(20)12-8-6-5-7-9-12/h5-9,13H,3-4,10-11H2,1-2H3
InChIKey
BQWDCWDJASHHKV-UHFFFAOYSA-N
Compound name
1-benzoyl-N,N-diethyl-5-oxopyrrolidine-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

288.1474 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 289.154676 168.0
[M+Na]+ 311.136618 172.8
[M-H]- 287.140124 174.3
[M+NH4]+ 306.181223 184.0
[M+K]+ 327.110558 171.2
[M+H-H2O]+ 271.144660 159.8
[M+HCOO]- 333.145601 189.0
[M+CH3COO]- 347.161251 205.9
[M+Na-2H]- 309.122066 166.6
[M]+ 288.14685142 168.3
[M]- 288.14794858 168.3
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.