CID 16226783

N-tert-butyl-3,5-dimethyl-1h-pyrazole-4-sulfonamide

Structural Information

Molecular Formula
C9H17N3O2S
SMILES
CC1=C(C(=NN1)C)S(=O)(=O)NC(C)(C)C
InChI
InChI=1S/C9H17N3O2S/c1-6-8(7(2)11-10-6)15(13,14)12-9(3,4)5/h12H,1-5H3,(H,10,11)
InChIKey
ZVUFXVOWXLBOGH-UHFFFAOYSA-N
Compound name
N-tert-butyl-3,5-dimethyl-1H-pyrazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.10414 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.11142 154.8
[M+Na]+ 254.09336 162.9
[M+NH4]+ 249.13796 160.2
[M+K]+ 270.06730 159.9
[M-H]- 230.09686 152.8
[M+Na-2H]- 252.07881 156.9
[M]+ 231.10359 155.6
[M]- 231.10469 155.6
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.