CID 16228087

1,3,5-trimethyl-1h-pyrazole-4-sulfonamide

Structural Information

Molecular Formula
C6H11N3O2S
SMILES
CC1=C(C(=NN1C)C)S(=O)(=O)N
InChI
InChI=1S/C6H11N3O2S/c1-4-6(12(7,10)11)5(2)9(3)8-4/h1-3H3,(H2,7,10,11)
InChIKey
AAEHWFDPJWBCBB-UHFFFAOYSA-N
Compound name
1,3,5-trimethylpyrazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

189.0572 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.06448 141.3
[M+Na]+ 212.04642 151.0
[M+NH4]+ 207.09102 147.6
[M+K]+ 228.02036 147.5
[M-H]- 188.04992 140.4
[M+Na-2H]- 210.03187 144.0
[M]+ 189.05665 142.6
[M]- 189.05775 142.6
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