CID 368839

Nsc640164

Structural Information

Molecular Formula
C8H12N2O5S2
SMILES
COC1=CC=C(C=C1)S(=O)(=O)NNS(=O)(=O)C
InChI
InChI=1S/C8H12N2O5S2/c1-15-7-3-5-8(6-4-7)17(13,14)10-9-16(2,11)12/h3-6,9-10H,1-2H3
InChIKey
UAMYEQHRQGNODE-UHFFFAOYSA-N
Compound name
4-methoxy-N'-methylsulfonylbenzenesulfonohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

280.01877 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 281.02605 157.7
[M+Na]+ 303.00799 164.9
[M-H]- 279.01149 160.8
[M+NH4]+ 298.05259 172.9
[M+K]+ 318.98193 160.8
[M+H-H2O]+ 263.01603 150.9
[M+HCOO]- 325.01697 171.7
[M+CH3COO]- 339.03262 195.8
[M+Na-2H]- 300.99344 163.7
[M]+ 280.01822 161.6
[M]- 280.01932 161.6
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.