CID 117684

4-thiazolidinone, 3-ethyl-5-(1-ethyl-4(1h)-pyridinylidene)-2-thioxo-

Structural Information

Molecular Formula
C12H14N2OS2
SMILES
CCN1C=CC(=C2C(=O)N(C(=S)S2)CC)C=C1
InChI
InChI=1S/C12H14N2OS2/c1-3-13-7-5-9(6-8-13)10-11(15)14(4-2)12(16)17-10/h5-8H,3-4H2,1-2H3
InChIKey
URVNGLXEYBEJIN-UHFFFAOYSA-N
Compound name
3-ethyl-5-(1-ethylpyridin-4-ylidene)-2-sulfanylidene-1,3-thiazolidin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

266.05475 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 267.06203 161.8
[M+Na]+ 289.04397 172.7
[M+NH4]+ 284.08857 169.7
[M+K]+ 305.01791 163.8
[M-H]- 265.04747 164.1
[M+Na-2H]- 287.02942 164.7
[M]+ 266.05420 164.7
[M]- 266.05530 164.7
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