CID 8032595

38530-07-3

Structural Information

Molecular Formula
C8H6N2O2
SMILES
C1=COC(=C1)C2=NNC(=O)C=C2
InChI
InChI=1S/C8H6N2O2/c11-8-4-3-6(9-10-8)7-2-1-5-12-7/h1-5H,(H,10,11)
InChIKey
WUTQMDHLNJSJPZ-UHFFFAOYSA-N
Compound name
3-(furan-2-yl)-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

3
Patents

162.04292 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.05020 130.0
[M+Na]+ 185.03214 144.1
[M+NH4]+ 180.07674 137.8
[M+K]+ 201.00608 140.3
[M-H]- 161.03564 133.2
[M+Na-2H]- 183.01759 138.1
[M]+ 162.04237 132.8
[M]- 162.04347 132.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe