CID 3073802

6-(3-(n,n-dimethylsulfamoyl)-1-propoxy)(1,2,4)triazolo(1,5-b)pyridazine

Structural Information

Molecular Formula
C10H15N5O3S
SMILES
CN(C)S(=O)(=O)CCCOC1=NN2C(=NC=N2)C=C1
InChI
InChI=1S/C10H15N5O3S/c1-14(2)19(16,17)7-3-6-18-10-5-4-9-11-8-12-15(9)13-10/h4-5,8H,3,6-7H2,1-2H3
InChIKey
JTHXYOOTQWASQF-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-([1,2,4]triazolo[1,5-b]pyridazin-6-yloxy)propane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

285.08957 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.09685 162.2
[M+Na]+ 308.07879 172.7
[M-H]- 284.08229 163.9
[M+NH4]+ 303.12339 176.6
[M+K]+ 324.05273 170.5
[M+H-H2O]+ 268.08683 154.0
[M+HCOO]- 330.08777 179.1
[M+CH3COO]- 344.10342 200.6
[M+Na-2H]- 306.06424 168.4
[M]+ 285.08902 170.9
[M]- 285.09012 170.9
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

patents stripe