CID 341510

Brn 5555448

Structural Information

Molecular Formula
C9H12N4O2S
SMILES
CCN1C2=CC=CC=C2S(=O)(=O)N=C1NN
InChI
InChI=1S/C9H12N4O2S/c1-2-13-7-5-3-4-6-8(7)16(14,15)12-9(13)11-10/h3-6H,2,10H2,1H3,(H,11,12)
InChIKey
DFOFKVOURVXSFW-UHFFFAOYSA-N
Compound name
(4-ethyl-1,1-dioxo-1lambda6,2,4-benzothiadiazin-3-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.0681 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.07538 146.9
[M+Na]+ 263.05732 157.3
[M-H]- 239.06082 148.9
[M+NH4]+ 258.10192 165.1
[M+K]+ 279.03126 153.1
[M+H-H2O]+ 223.06536 140.2
[M+HCOO]- 285.06630 164.2
[M+CH3COO]- 299.08195 192.6
[M+Na-2H]- 261.04277 154.0
[M]+ 240.06755 148.0
[M]- 240.06865 148.0
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.