CID 341509

Brn 5552024

Structural Information

Molecular Formula
C8H10N4O2S
SMILES
CN1C2=CC=CC=C2S(=O)(=O)N=C1NN
InChI
InChI=1S/C8H10N4O2S/c1-12-6-4-2-3-5-7(6)15(13,14)11-8(12)10-9/h2-5H,9H2,1H3,(H,10,11)
InChIKey
RLJREWYVJDGKMF-UHFFFAOYSA-N
Compound name
(4-methyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.05244 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.059716 142.7
[M+Na]+ 249.041658 153.5
[M-H]- 225.045164 144.9
[M+NH4]+ 244.086263 161.4
[M+K]+ 265.015598 149.5
[M+H-H2O]+ 209.049700 136.2
[M+HCOO]- 271.050641 160.3
[M+CH3COO]- 285.066291 189.6
[M+Na-2H]- 247.027106 150.2
[M]+ 226.05189142 143.5
[M]- 226.05298858 143.5
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.