CID 367388

Nsc637077

Structural Information

Molecular Formula

C₇H₁₀N₂O₄S₂

SMILES

CS(=O)(=O)NNS(=O)(=O)C1=CC=CC=C1

InChI

InChI=1S/C7H10N2O4S2/c1-14(10,11)8-9-15(12,13)7-5-3-2-4-6-7/h2-6,8-9H,1H3

InChIKey

NZRCHFUOJKRCRE-UHFFFAOYSA-N

Compound name

N'-methylsulfonylbenzenesulfonohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 18
Patents: 250.0082 Da
Monoisotopic Mass: 0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	251.01548	150.9
[M+Na]+	272.99742	158.1
[M-H]-	249.00092	153.9
[M+NH4]+	268.04202	167.2
[M+K]+	288.97136	153.7
[M+H-H2O]+	233.00546	144.4
[M+HCOO]-	295.00640	165.1
[M+CH3COO]-	309.02205	189.5
[M+Na-2H]-	270.98287	157.5
[M]+	250.00765	152.7
[M]-	250.00875	152.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe