CID 199657

3-pyrazoline-4-sulfonamide, 5-oxo-1-phenyl-n,n,2,3-tetramethyl-

Structural Information

Molecular Formula
C13H17N3O3S
SMILES
CC1=C(C(=O)N(N1C)C2=CC=CC=C2)S(=O)(=O)N(C)C
InChI
InChI=1S/C13H17N3O3S/c1-10-12(20(18,19)14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3
InChIKey
KRKBXLYBSJACEL-UHFFFAOYSA-N
Compound name
N,N,1,5-tetramethyl-3-oxo-2-phenylpyrazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.09906 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.10634 167.4
[M+Na]+ 318.08828 179.0
[M+NH4]+ 313.13288 173.3
[M+K]+ 334.06222 174.5
[M-H]- 294.09178 168.9
[M+Na-2H]- 316.07373 172.9
[M]+ 295.09851 169.8
[M]- 295.09961 169.8
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.