CID 3074285

2-methyl-2-(2-(2-propyl-1,3-dithiolan-2-yl)ethyl)thiazolidine

Structural Information

Molecular Formula
C12H23NS3
SMILES
CCCC1(SCCS1)CCC2(NCCS2)C
InChI
InChI=1S/C12H23NS3/c1-3-4-12(15-9-10-16-12)6-5-11(2)13-7-8-14-11/h13H,3-10H2,1-2H3
InChIKey
UTLUFWABAWXKBZ-UHFFFAOYSA-N
Compound name
2-methyl-2-[2-(2-propyl-1,3-dithiolan-2-yl)ethyl]-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

277.09927 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.10655 157.1
[M+Na]+ 300.08849 163.0
[M+NH4]+ 295.13309 168.9
[M+K]+ 316.06243 151.6
[M-H]- 276.09199 159.3
[M+Na-2H]- 298.07394 161.8
[M]+ 277.09872 160.1
[M]- 277.09982 160.1
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.