CID 526613

3,6-dimethyl-1,2,4,5-tetrathiane

Structural Information

Molecular Formula
C4H8S4
SMILES
CC1SSC(SS1)C
InChI
InChI=1S/C4H8S4/c1-3-5-7-4(2)8-6-3/h3-4H,1-2H3
InChIKey
OLLSVBUNSGNIRV-UHFFFAOYSA-N
Compound name
3,6-dimethyl-1,2,4,5-tetrathiane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

5
Patents

183.95088 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.95816 126.4
[M+Na]+ 206.94010 135.3
[M+NH4]+ 201.98470 137.1
[M+K]+ 222.91404 123.6
[M-H]- 182.94360 129.8
[M+Na-2H]- 204.92555 129.0
[M]+ 183.95033 130.4
[M]- 183.95143 130.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe