CID 26202

2,4-dichloro-6-(methylthio)-1,3,5-triazine

Structural Information

Molecular Formula
C4H3Cl2N3S
SMILES
CSC1=NC(=NC(=N1)Cl)Cl
InChI
InChI=1S/C4H3Cl2N3S/c1-10-4-8-2(5)7-3(6)9-4/h1H3
InChIKey
MWPZLWRHHPWTFS-UHFFFAOYSA-N
Compound name
2,4-dichloro-6-methylsulfanyl-1,3,5-triazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

95
Patents

194.94247 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.94975 135.7
[M+Na]+ 217.93169 151.3
[M+NH4]+ 212.97629 144.7
[M+K]+ 233.90563 141.8
[M-H]- 193.93519 136.8
[M+Na-2H]- 215.91714 142.6
[M]+ 194.94192 139.3
[M]- 194.94302 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