CID 514160

2h-1,3,5-thiadiazine-2,4(3h)-dione, 6-(1-methylethyl)-

Structural Information

Molecular Formula
C6H8N2O2S
SMILES
CC(C)C1=NC(=O)NC(=O)S1
InChI
InChI=1S/C6H8N2O2S/c1-3(2)4-7-5(9)8-6(10)11-4/h3H,1-2H3,(H,8,9,10)
InChIKey
SWBZIPFYSBQFGG-UHFFFAOYSA-N
Compound name
6-propan-2-yl-1,3,5-thiadiazine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

172.03065 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.03793 130.8
[M+Na]+ 195.01987 141.3
[M-H]- 171.02337 131.5
[M+NH4]+ 190.06447 148.8
[M+K]+ 210.99381 138.0
[M+H-H2O]+ 155.02791 124.7
[M+HCOO]- 217.02885 146.7
[M+CH3COO]- 231.04450 174.5
[M+Na-2H]- 193.00532 134.0
[M]+ 172.03010 132.5
[M]- 172.03120 132.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.