CID 43540537

2470438-76-5

Structural Information

Molecular Formula
C10H11N3O2S
SMILES
C1=CC=C(C=C1)CS(=O)(=O)NC2=CNN=C2
InChI
InChI=1S/C10H11N3O2S/c14-16(15,13-10-6-11-12-7-10)8-9-4-2-1-3-5-9/h1-7,13H,8H2,(H,11,12)
InChIKey
PMPOMPYUAFIRQQ-UHFFFAOYSA-N
Compound name
1-phenyl-N-(1H-pyrazol-4-yl)methanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

237.0572 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 238.06448 150.0
[M+Na]+ 260.04642 158.4
[M-H]- 236.04992 153.3
[M+NH4]+ 255.09102 166.1
[M+K]+ 276.02036 153.8
[M+H-H2O]+ 220.05446 142.7
[M+HCOO]- 282.05540 167.7
[M+CH3COO]- 296.07105 184.3
[M+Na-2H]- 258.03187 155.3
[M]+ 237.05665 150.2
[M]- 237.05775 150.2
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.