CID 28818859

1-methyl-4-sulfamoyl-1h-pyrrole-2-carboxamide

Structural Information

Molecular Formula
C6H9N3O3S
SMILES
CN1C=C(C=C1C(=O)N)S(=O)(=O)N
InChI
InChI=1S/C6H9N3O3S/c1-9-3-4(13(8,11)12)2-5(9)6(7)10/h2-3H,1H3,(H2,7,10)(H2,8,11,12)
InChIKey
FPFGZTIXKKCTRV-UHFFFAOYSA-N
Compound name
1-methyl-4-sulfamoylpyrrole-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.03647 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.043746 140.6
[M+Na]+ 226.025688 149.8
[M-H]- 202.029194 143.0
[M+NH4]+ 221.070293 159.6
[M+K]+ 241.999628 147.4
[M+H-H2O]+ 186.033730 134.7
[M+HCOO]- 248.034671 159.4
[M+CH3COO]- 262.050321 184.6
[M+Na-2H]- 224.011136 142.0
[M]+ 203.03592142 140.9
[M]- 203.03701858 140.9
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.