CID 3735047

N-(4-methoxy-3-sulfamoylphenyl)acetamide

Structural Information

Molecular Formula
C9H12N2O4S
SMILES
CC(=O)NC1=CC(=C(C=C1)OC)S(=O)(=O)N
InChI
InChI=1S/C9H12N2O4S/c1-6(12)11-7-3-4-8(15-2)9(5-7)16(10,13)14/h3-5H,1-2H3,(H,11,12)(H2,10,13,14)
InChIKey
ICUOXTKSXMJNCN-UHFFFAOYSA-N
Compound name
N-(4-methoxy-3-sulfamoylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.05177 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.05905 150.0
[M+Na]+ 267.04099 157.8
[M-H]- 243.04449 153.7
[M+NH4]+ 262.08559 167.0
[M+K]+ 283.01493 155.4
[M+H-H2O]+ 227.04903 143.6
[M+HCOO]- 289.04997 169.2
[M+CH3COO]- 303.06562 193.2
[M+Na-2H]- 265.02644 153.3
[M]+ 244.05122 152.5
[M]- 244.05232 152.5
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.