CID 215698

Brn 1536968

Structural Information

Molecular Formula
C12H16N2O3S
SMILES
CC1(CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N)C
InChI
InChI=1S/C12H16N2O3S/c1-12(2)7-11(15)14(8-12)9-3-5-10(6-4-9)18(13,16)17/h3-6H,7-8H2,1-2H3,(H2,13,16,17)
InChIKey
VMNUIIDTNLFMJL-UHFFFAOYSA-N
Compound name
4-(4,4-dimethyl-2-oxopyrrolidin-1-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

268.08817 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.095446 158.1
[M+Na]+ 291.077388 167.4
[M-H]- 267.080894 163.8
[M+NH4]+ 286.121993 177.3
[M+K]+ 307.051328 163.8
[M+H-H2O]+ 251.085430 152.7
[M+HCOO]- 313.086371 174.7
[M+CH3COO]- 327.102021 194.4
[M+Na-2H]- 289.062836 160.1
[M]+ 268.08762142 159.0
[M]- 268.08871858 159.0
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