CID 3056919

73908-86-8

Structural Information

Molecular Formula
C5H10N2O2S
SMILES
CC1CC(=NS(=O)(=O)N1)C
InChI
InChI=1S/C5H10N2O2S/c1-4-3-5(2)7-10(8,9)6-4/h4,6H,3H2,1-2H3
InChIKey
WLGBLOBPBOQFLI-UHFFFAOYSA-N
Compound name
3,5-dimethyl-3,4-dihydro-2H-1,2,6-thiadiazine 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

162.0463 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.053576 128.4
[M+Na]+ 185.035518 138.3
[M-H]- 161.039024 128.7
[M+NH4]+ 180.080123 148.7
[M+K]+ 201.009458 135.8
[M+H-H2O]+ 145.043560 123.4
[M+HCOO]- 207.044501 142.8
[M+CH3COO]- 221.060151 170.9
[M+Na-2H]- 183.020966 132.9
[M]+ 162.04575142 128.0
[M]- 162.04684858 128.0
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.