CID 208337

32002-25-8

Structural Information

Molecular Formula
C7H8N4O2
SMILES
CCOC1=CC(=O)C2=NN=CN2N1
InChI
InChI=1S/C7H8N4O2/c1-2-13-6-3-5(12)7-9-8-4-11(7)10-6/h3-4,10H,2H2,1H3
InChIKey
BGJGKWYENWOHQP-UHFFFAOYSA-N
Compound name
6-ethoxy-5H-[1,2,4]triazolo[4,3-b]pyridazin-8-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

180.06473 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 181.07201 135.1
[M+Na]+ 203.05395 148.6
[M+NH4]+ 198.09855 141.5
[M+K]+ 219.02789 145.3
[M-H]- 179.05745 133.8
[M+Na-2H]- 201.03940 140.8
[M]+ 180.06418 136.4
[M]- 180.06528 136.4
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.