CID 3073782

152537-14-9

Structural Information

Molecular Formula
C10H15N5O3S
SMILES
CC(C)(COC1=NN2C(=NC=N2)C=C1)CS(=O)(=O)N
InChI
InChI=1S/C10H15N5O3S/c1-10(2,6-19(11,16)17)5-18-9-4-3-8-12-7-13-15(8)14-9/h3-4,7H,5-6H2,1-2H3,(H2,11,16,17)
InChIKey
ULJMBTIWHIEYSC-UHFFFAOYSA-N
Compound name
2,2-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

8
Patents

285.08957 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.09685 165.3
[M+Na]+ 308.07879 175.9
[M-H]- 284.08229 165.2
[M+NH4]+ 303.12339 178.8
[M+K]+ 324.05273 172.4
[M+H-H2O]+ 268.08683 158.0
[M+HCOO]- 330.08777 179.4
[M+CH3COO]- 344.10342 197.2
[M+Na-2H]- 306.06424 172.0
[M]+ 285.08902 171.1
[M]- 285.09012 171.1
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