CID 3049670

Pb 194

Structural Information

Molecular Formula
C17H15FN2O4S
SMILES
CC1(CC(=O)N(C1=O)C2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3F
InChI
InChI=1S/C17H15FN2O4S/c1-17(13-4-2-3-5-14(13)18)10-15(21)20(16(17)22)11-6-8-12(9-7-11)25(19,23)24/h2-9H,10H2,1H3,(H2,19,23,24)
InChIKey
MBHNSEQWNPNYJT-UHFFFAOYSA-N
Compound name
4-[3-(2-fluorophenyl)-3-methyl-2,5-dioxopyrrolidin-1-yl]benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

362.07367 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 363.08095 180.3
[M+Na]+ 385.06289 190.4
[M-H]- 361.06639 188.1
[M+NH4]+ 380.10749 195.3
[M+K]+ 401.03683 185.0
[M+H-H2O]+ 345.07093 172.5
[M+HCOO]- 407.07187 195.9
[M+CH3COO]- 421.08752 212.1
[M+Na-2H]- 383.04834 180.7
[M]+ 362.07312 180.9
[M]- 362.07422 180.9
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.