CID 125455482

5-chloropyrazolo[1,5-a]pyrimidine-3-sulfonamide

Structural Information

Molecular Formula
C6H5ClN4O2S
SMILES
C1=CN2C(=C(C=N2)S(=O)(=O)N)N=C1Cl
InChI
InChI=1S/C6H5ClN4O2S/c7-5-1-2-11-6(10-5)4(3-9-11)14(8,12)13/h1-3H,(H2,8,12,13)
InChIKey
CKAAMVXVCWYVMN-UHFFFAOYSA-N
Compound name
5-chloropyrazolo[1,5-a]pyrimidine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.98218 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.98946 144.6
[M+Na]+ 254.97140 157.5
[M+NH4]+ 250.01600 151.7
[M+K]+ 270.94534 152.4
[M-H]- 230.97490 144.3
[M+Na-2H]- 252.95685 149.8
[M]+ 231.98163 146.9
[M]- 231.98273 146.9
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.