CID 85824626

Dihydro-4,6-dimethyl-4h-1,3,5-dithiazine

Structural Information

Molecular Formula
C5H11NS2
SMILES
CC1NC(SCS1)C
InChI
InChI=1S/C5H11NS2/c1-4-6-5(2)8-3-7-4/h4-6H,3H2,1-2H3
InChIKey
SORBXLXSXNAVRV-UHFFFAOYSA-N
Compound name
4,6-dimethyl-1,3,5-dithiazinane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

149.0333 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.04058 125.9
[M+Na]+ 172.02252 132.8
[M-H]- 148.02602 126.3
[M+NH4]+ 167.06712 146.0
[M+K]+ 187.99646 129.2
[M+H-H2O]+ 132.03056 120.8
[M+HCOO]- 194.03150 133.7
[M+CH3COO]- 208.04715 170.5
[M+Na-2H]- 170.00797 126.3
[M]+ 149.03275 122.3
[M]- 149.03385 122.3
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.