CID 75355934

1-(cyclopropylmethyl)-1h-pyrazole-4-sulfonamide

Structural Information

Molecular Formula
C7H11N3O2S
SMILES
C1CC1CN2C=C(C=N2)S(=O)(=O)N
InChI
InChI=1S/C7H11N3O2S/c8-13(11,12)7-3-9-10(5-7)4-6-1-2-6/h3,5-6H,1-2,4H2,(H2,8,11,12)
InChIKey
UKIMBZAGEPTCBG-UHFFFAOYSA-N
Compound name
1-(cyclopropylmethyl)pyrazole-4-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

201.0572 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 202.064476 143.1
[M+Na]+ 224.046418 154.1
[M-H]- 200.049924 148.1
[M+NH4]+ 219.091023 156.7
[M+K]+ 240.020358 149.6
[M+H-H2O]+ 184.054460 136.3
[M+HCOO]- 246.055401 161.3
[M+CH3COO]- 260.071051 184.4
[M+Na-2H]- 222.031866 146.1
[M]+ 201.05665142 146.7
[M]- 201.05774858 146.7
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

patents stripe