CID 155819729

1-ethenyl-1h-1,2,3-triazole-5-sulfonamide

Structural Information

Molecular Formula
C4H6N4O2S
SMILES
C=CN1C(=CN=N1)S(=O)(=O)N
InChI
InChI=1S/C4H6N4O2S/c1-2-8-4(3-6-7-8)11(5,9)10/h2-3H,1H2,(H2,5,9,10)
InChIKey
XMGTXYAVAHELLA-UHFFFAOYSA-N
Compound name
3-ethenyltriazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.02115 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.028426 134.0
[M+Na]+ 197.010368 145.0
[M-H]- 173.013874 134.3
[M+NH4]+ 192.054973 152.2
[M+K]+ 212.984308 142.3
[M+H-H2O]+ 157.018410 127.4
[M+HCOO]- 219.019351 151.5
[M+CH3COO]- 233.035001 175.6
[M+Na-2H]- 194.995816 137.9
[M]+ 174.02060142 135.2
[M]- 174.02169858 135.2
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.