CID 64182312

2-(4-methyl-1,3-thiazol-5-yl)ethane-1-sulfonamide

Structural Information

Molecular Formula
C6H10N2O2S2
SMILES
CC1=C(SC=N1)CCS(=O)(=O)N
InChI
InChI=1S/C6H10N2O2S2/c1-5-6(11-4-8-5)2-3-12(7,9)10/h4H,2-3H2,1H3,(H2,7,9,10)
InChIKey
XEHUYHBEUDNCKL-UHFFFAOYSA-N
Compound name
2-(4-methyl-1,3-thiazol-5-yl)ethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

27
Patents

206.01837 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 207.02565 142.1
[M+Na]+ 229.00759 151.9
[M-H]- 205.01109 144.4
[M+NH4]+ 224.05219 161.9
[M+K]+ 244.98153 147.9
[M+H-H2O]+ 189.01563 136.5
[M+HCOO]- 251.01657 155.6
[M+CH3COO]- 265.03222 181.7
[M+Na-2H]- 226.99304 143.1
[M]+ 206.01782 144.6
[M]- 206.01892 144.6
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