CID 165453591

2138187-22-9

Structural Information

Molecular Formula
C3HClFNO2S2
SMILES
C1=C(SC(=N1)Cl)S(=O)(=O)F
InChI
InChI=1S/C3HClFNO2S2/c4-3-6-1-2(9-3)10(5,7)8/h1H
InChIKey
OOWVYDSDNDFNMF-UHFFFAOYSA-N
Compound name
2-chloro-1,3-thiazole-5-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

200.91212 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.91940 132.3
[M+Na]+ 223.90134 144.8
[M-H]- 199.90484 134.8
[M+NH4]+ 218.94594 153.8
[M+K]+ 239.87528 140.4
[M+H-H2O]+ 183.90938 127.8
[M+HCOO]- 245.91032 141.0
[M+CH3COO]- 259.92597 175.3
[M+Na-2H]- 221.88679 134.1
[M]+ 200.91157 136.2
[M]- 200.91267 136.2
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.