CID 13277847

Brn 5621732

Structural Information

Molecular Formula
C15H15N3O5S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NNC(=O)C(=O)NC2=CC=C(C=C2)O
InChI
InChI=1S/C15H15N3O5S/c1-10-2-8-13(9-3-10)24(22,23)18-17-15(21)14(20)16-11-4-6-12(19)7-5-11/h2-9,18-19H,1H3,(H,16,20)(H,17,21)
InChIKey
PIZGTAOHGZPISR-UHFFFAOYSA-N
Compound name
N-(4-hydroxyphenyl)-2-[2-(4-methylphenyl)sulfonylhydrazinyl]-2-oxoacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

349.07324 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 350.08052 176.2
[M+Na]+ 372.06246 181.0
[M-H]- 348.06596 181.4
[M+NH4]+ 367.10706 187.3
[M+K]+ 388.03640 177.3
[M+H-H2O]+ 332.07050 167.9
[M+HCOO]- 394.07144 194.4
[M+CH3COO]- 408.08709 212.0
[M+Na-2H]- 370.04791 180.1
[M]+ 349.07269 176.6
[M]- 349.07379 176.6
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.