CID 55280414

2-ethyl-1,3-thiazole-5-sulfonyl chloride

Structural Information

Molecular Formula
C5H6ClNO2S2
SMILES
CCC1=NC=C(S1)S(=O)(=O)Cl
InChI
InChI=1S/C5H6ClNO2S2/c1-2-4-7-3-5(10-4)11(6,8)9/h3H,2H2,1H3
InChIKey
YGJJLEKBSKRZRI-UHFFFAOYSA-N
Compound name
2-ethyl-1,3-thiazole-5-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.95285 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.96013 144.7
[M+Na]+ 233.94207 155.6
[M+NH4]+ 228.98667 153.0
[M+K]+ 249.91601 148.0
[M-H]- 209.94557 144.7
[M+Na-2H]- 231.92752 147.9
[M]+ 210.95230 147.4
[M]- 210.95340 147.4
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

No patent data available for this compound.