CID 215699

4-(4-ethyl-4-methyl-2-oxopyrrolidin-1-yl)benzenesulfonamide

Structural Information

Molecular Formula
C13H18N2O3S
SMILES
CCC1(CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N)C
InChI
InChI=1S/C13H18N2O3S/c1-3-13(2)8-12(16)15(9-13)10-4-6-11(7-5-10)19(14,17)18/h4-7H,3,8-9H2,1-2H3,(H2,14,17,18)
InChIKey
QUQSRPRFAMRTSM-UHFFFAOYSA-N
Compound name
4-(4-ethyl-4-methyl-2-oxopyrrolidin-1-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

282.10382 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 283.11110 162.4
[M+Na]+ 305.09304 171.2
[M-H]- 281.09654 167.9
[M+NH4]+ 300.13764 181.0
[M+K]+ 321.06698 167.4
[M+H-H2O]+ 265.10108 156.8
[M+HCOO]- 327.10202 178.6
[M+CH3COO]- 341.11767 197.5
[M+Na-2H]- 303.07849 163.9
[M]+ 282.10327 163.6
[M]- 282.10437 163.6
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