CID 17262698

1-ethyl-1h-pyrazole-4-sulfonamide

Structural Information

Molecular Formula
C5H9N3O2S
SMILES
CCN1C=C(C=N1)S(=O)(=O)N
InChI
InChI=1S/C5H9N3O2S/c1-2-8-4-5(3-7-8)11(6,9)10/h3-4H,2H2,1H3,(H2,6,9,10)
InChIKey
LYLRCLRAOORSIQ-UHFFFAOYSA-N
Compound name
1-ethylpyrazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

175.04155 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.04883 134.5
[M+Na]+ 198.03077 144.8
[M-H]- 174.03427 136.0
[M+NH4]+ 193.07537 154.2
[M+K]+ 214.00471 142.6
[M+H-H2O]+ 158.03881 128.4
[M+HCOO]- 220.03975 152.9
[M+CH3COO]- 234.05540 176.6
[M+Na-2H]- 196.01622 138.2
[M]+ 175.04100 136.4
[M]- 175.04210 136.4
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