CID 207602

30279-22-2

Structural Information

Molecular Formula
C17H15ClN2O4S
SMILES
CC1(CC(=O)N(C1=O)C2=C(C=CC(=C2)S(=O)(=O)N)Cl)C3=CC=CC=C3
InChI
InChI=1S/C17H15ClN2O4S/c1-17(11-5-3-2-4-6-11)10-15(21)20(16(17)22)14-9-12(25(19,23)24)7-8-13(14)18/h2-9H,10H2,1H3,(H2,19,23,24)
InChIKey
LQBRPBYVMRWPBM-UHFFFAOYSA-N
Compound name
4-chloro-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

378.0441 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.05138 184.6
[M+Na]+ 401.03332 195.4
[M-H]- 377.03682 193.9
[M+NH4]+ 396.07792 200.0
[M+K]+ 417.00726 189.0
[M+H-H2O]+ 361.04136 178.5
[M+HCOO]- 423.04230 196.8
[M+CH3COO]- 437.05795 213.0
[M+Na-2H]- 399.01877 185.1
[M]+ 378.04355 188.4
[M]- 378.04465 188.4
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.