CID 3051710

Pb 1930

Structural Information

Molecular Formula
C14H20N2O3S
SMILES
CCC1(CCC(=O)N1C2=CC=C(C=C2)S(=O)(=O)N)CC
InChI
InChI=1S/C14H20N2O3S/c1-3-14(4-2)10-9-13(17)16(14)11-5-7-12(8-6-11)20(15,18)19/h5-8H,3-4,9-10H2,1-2H3,(H2,15,18,19)
InChIKey
BNTXDYDHLIGLIF-UHFFFAOYSA-N
Compound name
4-(2,2-diethyl-5-oxopyrrolidin-1-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

296.11948 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 297.12676 166.7
[M+Na]+ 319.10870 175.0
[M-H]- 295.11220 172.0
[M+NH4]+ 314.15330 184.7
[M+K]+ 335.08264 171.0
[M+H-H2O]+ 279.11674 160.9
[M+HCOO]- 341.11768 182.6
[M+CH3COO]- 355.13333 200.5
[M+Na-2H]- 317.09415 167.7
[M]+ 296.11893 168.2
[M]- 296.12003 168.2
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

patents stripe