CID 203434

Ethylenebisrhodanine

Structural Information

Molecular Formula
C8H8N2O2S4
SMILES
C1C(=O)N(C(=S)S1)CCN2C(=O)CSC2=S
InChI
InChI=1S/C8H8N2O2S4/c11-5-3-15-7(13)9(5)1-2-10-6(12)4-16-8(10)14/h1-4H2
InChIKey
MMOVOMSMFLJLDS-UHFFFAOYSA-N
Compound name
3-[2-(4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl)ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

32
Patents

291.94687 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.95415 164.6
[M+Na]+ 314.93609 171.2
[M+NH4]+ 309.98069 171.7
[M+K]+ 330.91003 162.7
[M-H]- 290.93959 165.5
[M+Na-2H]- 312.92154 163.0
[M]+ 291.94632 167.1
[M]- 291.94742 167.1
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

patents stripe