CID 168167

N(4)-acetylsulfadimethoxine

Structural Information

Molecular Formula
C14H16N4O5S
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=CC(=N2)OC)OC
InChI
InChI=1S/C14H16N4O5S/c1-9(19)15-10-4-6-11(7-5-10)24(20,21)18-14-16-12(22-2)8-13(17-14)23-3/h4-8H,1-3H3,(H,15,19)(H,16,17,18)
InChIKey
DQWIIKBKAIPUPY-UHFFFAOYSA-N
Compound name
N-[4-[(4,6-dimethoxypyrimidin-2-yl)sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

14
References

0
Patents

352.08414 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 353.09142 177.8
[M+Na]+ 375.07336 185.3
[M-H]- 351.07686 182.5
[M+NH4]+ 370.11796 187.7
[M+K]+ 391.04730 182.0
[M+H-H2O]+ 335.08140 168.5
[M+HCOO]- 397.08234 195.2
[M+CH3COO]- 411.09799 213.7
[M+Na-2H]- 373.05881 182.6
[M]+ 352.08359 183.2
[M]- 352.08469 183.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.