CID 206540

28103-56-2

Structural Information

Molecular Formula
C17H16N2O4S
SMILES
CC1(CC(=O)N(C1=O)C2=CC(=CC=C2)S(=O)(=O)N)C3=CC=CC=C3
InChI
InChI=1S/C17H16N2O4S/c1-17(12-6-3-2-4-7-12)11-15(20)19(16(17)21)13-8-5-9-14(10-13)24(18,22)23/h2-10H,11H2,1H3,(H2,18,22,23)
InChIKey
HAZYHOBPGPZRHR-UHFFFAOYSA-N
Compound name
3-(3-methyl-2,5-dioxo-3-phenylpyrrolidin-1-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

344.08307 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 345.09035 178.1
[M+Na]+ 367.07229 187.5
[M-H]- 343.07579 187.0
[M+NH4]+ 362.11689 193.7
[M+K]+ 383.04623 182.5
[M+H-H2O]+ 327.08033 171.1
[M+HCOO]- 389.08127 194.9
[M+CH3COO]- 403.09692 208.2
[M+Na-2H]- 365.05774 179.6
[M]+ 344.08252 179.3
[M]- 344.08362 179.3
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.