CID 16427159

1,3-thiazole-2-sulfonyl fluoride

Structural Information

Molecular Formula
C3H2FNO2S2
SMILES
C1=CSC(=N1)S(=O)(=O)F
InChI
InChI=1S/C3H2FNO2S2/c4-9(6,7)3-5-1-2-8-3/h1-2H
InChIKey
ZTEVDEORQHXCNV-UHFFFAOYSA-N
Compound name
1,3-thiazole-2-sulfonyl fluoride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.9511 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.95838 127.3
[M+Na]+ 189.94032 138.7
[M-H]- 165.94382 129.3
[M+NH4]+ 184.98492 149.1
[M+K]+ 205.91426 135.9
[M+H-H2O]+ 149.94836 121.7
[M+HCOO]- 211.94930 140.7
[M+CH3COO]- 225.96495 170.4
[M+Na-2H]- 187.92577 130.0
[M]+ 166.95055 129.3
[M]- 166.95165 129.3
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.