CID 3056922

73908-89-1

Structural Information

Molecular Formula
C10H20N2O2S
SMILES
CCC1=NS(=O)(=O)NC(C1C)(CC)CC
InChI
InChI=1S/C10H20N2O2S/c1-5-9-8(4)10(6-2,7-3)12-15(13,14)11-9/h8,12H,5-7H2,1-4H3
InChIKey
LXTNLLCYIOIXLO-UHFFFAOYSA-N
Compound name
3,3,5-triethyl-4-methyl-2,4-dihydro-1,2,6-thiadiazine 1,1-dioxide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.12454 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.131816 146.0
[M+Na]+ 255.113758 155.3
[M-H]- 231.117264 145.9
[M+NH4]+ 250.158363 165.7
[M+K]+ 271.087698 152.2
[M+H-H2O]+ 215.121800 141.3
[M+HCOO]- 277.122741 158.7
[M+CH3COO]- 291.138391 186.9
[M+Na-2H]- 253.099206 149.2
[M]+ 232.12399142 148.3
[M]- 232.12508858 148.3
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.