CID 146013370

2172091-17-5

Structural Information

Molecular Formula
C9H7ClN2O2S2
SMILES
C1=CC=C(C=C1)C2=C(SC(=N2)Cl)S(=O)(=O)N
InChI
InChI=1S/C9H7ClN2O2S2/c10-9-12-7(6-4-2-1-3-5-6)8(15-9)16(11,13)14/h1-5H,(H2,11,13,14)
InChIKey
FARRYIZPKASCOE-UHFFFAOYSA-N
Compound name
2-chloro-4-phenyl-1,3-thiazole-5-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.96375 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.97103 156.4
[M+Na]+ 296.95297 168.0
[M-H]- 272.95647 162.6
[M+NH4]+ 291.99757 174.5
[M+K]+ 312.92691 161.4
[M+H-H2O]+ 256.96101 151.4
[M+HCOO]- 318.96195 166.3
[M+CH3COO]- 332.97760 191.1
[M+Na-2H]- 294.93842 157.8
[M]+ 273.96320 160.1
[M]- 273.96430 160.1
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.