CID 3074283

2-(2-(2-ethyl-1,3-dithiolan-2-yl)ethyl)-2-methylthiazolidine

Structural Information

Molecular Formula
C11H21NS3
SMILES
CCC1(SCCS1)CCC2(NCCS2)C
InChI
InChI=1S/C11H21NS3/c1-3-11(14-8-9-15-11)5-4-10(2)12-6-7-13-10/h12H,3-9H2,1-2H3
InChIKey
FCEVCZKNYOITFI-UHFFFAOYSA-N
Compound name
2-[2-(2-ethyl-1,3-dithiolan-2-yl)ethyl]-2-methyl-1,3-thiazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

263.08362 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.09090 155.0
[M+Na]+ 286.07284 161.8
[M-H]- 262.07634 157.2
[M+NH4]+ 281.11744 177.4
[M+K]+ 302.04678 157.2
[M+H-H2O]+ 246.08088 151.7
[M+HCOO]- 308.08182 157.8
[M+CH3COO]- 322.09747 165.0
[M+Na-2H]- 284.05829 153.1
[M]+ 263.08307 152.8
[M]- 263.08417 152.8
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.