CID 331659

2-chloro-3-((2-chloro-3-pyridinyl)dithio)pyridine

Structural Information

Molecular Formula
C10H6Cl2N2S2
SMILES
C1=CC(=C(N=C1)Cl)SSC2=C(N=CC=C2)Cl
InChI
InChI=1S/C10H6Cl2N2S2/c11-9-7(3-1-5-13-9)15-16-8-4-2-6-14-10(8)12/h1-6H
InChIKey
XTDQQHOMOGDPRZ-UHFFFAOYSA-N
Compound name
2-chloro-3-[(2-chloropyridin-3-yl)disulfanyl]pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

287.93494 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.94222 149.6
[M+Na]+ 310.92416 161.0
[M-H]- 286.92766 153.6
[M+NH4]+ 305.96876 165.0
[M+K]+ 326.89810 153.4
[M+H-H2O]+ 270.93220 143.8
[M+HCOO]- 332.93314 152.6
[M+CH3COO]- 346.94879 161.3
[M+Na-2H]- 308.90961 151.9
[M]+ 287.93439 154.4
[M]- 287.93549 154.4
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