CID 3047114

Semioxamazide, 5-hydroxy-1-(p-tolylsulfonyl)-

Structural Information

Molecular Formula
C9H11N3O5S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C(=O)NO
InChI
InChI=1S/C9H11N3O5S/c1-6-2-4-7(5-3-6)18(16,17)12-10-8(13)9(14)11-15/h2-5,12,15H,1H3,(H,10,13)(H,11,14)
InChIKey
CXWHVCBNZIAMNT-UHFFFAOYSA-N
Compound name
N-hydroxy-2-[2-(4-methylphenyl)sulfonylhydrazinyl]-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.04193 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.04921 157.1
[M+Na]+ 296.03115 162.9
[M+NH4]+ 291.07575 161.1
[M+K]+ 312.00509 159.8
[M-H]- 272.03465 156.0
[M+Na-2H]- 294.01660 159.9
[M]+ 273.04138 157.3
[M]- 273.04248 157.3
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.