CID 720086

N-[4-[(3-nitrophenyl)sulfamoyl]phenyl]acetamide

Structural Information

Molecular Formula
C14H13N3O5S
SMILES
CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)[N+](=O)[O-]
InChI
InChI=1S/C14H13N3O5S/c1-10(18)15-11-5-7-14(8-6-11)23(21,22)16-12-3-2-4-13(9-12)17(19)20/h2-9,16H,1H3,(H,15,18)
InChIKey
YNJQNZHJCLLYOD-UHFFFAOYSA-N
Compound name
N-[4-[(3-nitrophenyl)sulfamoyl]phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.0576 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.06488 168.1
[M+Na]+ 358.04682 178.8
[M+NH4]+ 353.09142 173.7
[M+K]+ 374.02076 175.5
[M-H]- 334.05032 172.1
[M+Na-2H]- 356.03227 175.2
[M]+ 335.05705 170.8
[M]- 335.05815 170.8
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.