CID 75552

Diallyl tetrasulfide

Structural Information

Molecular Formula
C6H10S4
SMILES
C=CCSSSSCC=C
InChI
InChI=1S/C6H10S4/c1-3-5-7-9-10-8-6-4-2/h3-4H,1-2,5-6H2
InChIKey
RMKCQUWJDRTEHE-UHFFFAOYSA-N
Compound name
3-(prop-2-enyltetrasulfanyl)prop-1-ene
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

34
References

778
Patents

209.96654 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.97382 140.3
[M+Na]+ 232.95576 147.2
[M-H]- 208.95926 138.4
[M+NH4]+ 228.00036 158.0
[M+K]+ 248.92970 138.3
[M+H-H2O]+ 192.96380 134.3
[M+HCOO]- 254.96474 140.1
[M+CH3COO]- 268.98039 187.3
[M+Na-2H]- 230.94121 138.4
[M]+ 209.96599 139.3
[M]- 209.96709 139.3
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