CID 3038337

27406-62-8

Structural Information

Molecular Formula
C10H20N2OS
SMILES
CCCN1C(=S)NC(CC1(C)O)(C)C
InChI
InChI=1S/C10H20N2OS/c1-5-6-12-8(14)11-9(2,3)7-10(12,4)13/h13H,5-7H2,1-4H3,(H,11,14)
InChIKey
RTZOSKZEQGBIFS-UHFFFAOYSA-N
Compound name
6-hydroxy-4,4,6-trimethyl-1-propyl-1,3-diazinane-2-thione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.12964 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.13692 145.7
[M+Na]+ 239.11886 153.4
[M-H]- 215.12236 143.8
[M+NH4]+ 234.16346 165.3
[M+K]+ 255.09280 149.8
[M+H-H2O]+ 199.12690 141.5
[M+HCOO]- 261.12784 155.1
[M+CH3COO]- 275.14349 183.4
[M+Na-2H]- 237.10431 147.4
[M]+ 216.12909 144.0
[M]- 216.13019 144.0
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.