CID 71945

Taurultam

Structural Information

Molecular Formula
C3H8N2O2S
SMILES
C1CS(=O)(=O)NCN1
InChI
InChI=1S/C3H8N2O2S/c6-8(7)2-1-4-3-5-8/h4-5H,1-3H2
InChIKey
RJGYJMFQWGPBGM-UHFFFAOYSA-N
Compound name
1,2,4-thiadiazinane 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

747
Patents

136.03065 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.03793 125.4
[M+Na]+ 159.01987 134.9
[M+NH4]+ 154.06447 134.0
[M+K]+ 174.99381 126.9
[M-H]- 135.02337 124.3
[M+Na-2H]- 157.00532 130.3
[M]+ 136.03010 126.6
[M]- 136.03120 126.6
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

patents stripe