CID 165985529

2-(4-fluorophenyl)-1,3-thiazole-5-sulfonyl chloride

Structural Information

Molecular Formula
C9H5ClFNO2S2
SMILES
C1=CC(=CC=C1C2=NC=C(S2)S(=O)(=O)Cl)F
InChI
InChI=1S/C9H5ClFNO2S2/c10-16(13,14)8-5-12-9(15-8)6-1-3-7(11)4-2-6/h1-5H
InChIKey
DSNMQISIGQDHEN-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-1,3-thiazole-5-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

276.94342 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.95070 156.6
[M+Na]+ 299.93264 169.0
[M+NH4]+ 294.97724 164.7
[M+K]+ 315.90658 160.6
[M-H]- 275.93614 157.8
[M+Na-2H]- 297.91809 162.4
[M]+ 276.94287 159.9
[M]- 276.94397 159.9
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