CID 55300147

2059999-55-0

Structural Information

Molecular Formula
C4H9NO2S
SMILES
C1CNCS(=O)(=O)C1
InChI
InChI=1S/C4H9NO2S/c6-8(7)3-1-2-5-4-8/h5H,1-4H2
InChIKey
SRDQFXQNSSVQDM-UHFFFAOYSA-N
Compound name
1,3-thiazinane 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

135.0354 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 136.04268 125.4
[M+Na]+ 158.02462 135.4
[M+NH4]+ 153.06922 135.0
[M+K]+ 173.99856 126.7
[M-H]- 134.02812 125.6
[M+Na-2H]- 156.01007 131.1
[M]+ 135.03485 127.2
[M]- 135.03595 127.2
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

patents stripe