CID 3017346

6-(2-hydroxyphenyl)pyridazin-3(2h)-one

Structural Information

Molecular Formula
C10H8N2O2
SMILES
C1=CC=C(C(=C1)C2=NNC(=O)C=C2)O
InChI
InChI=1S/C10H8N2O2/c13-9-4-2-1-3-7(9)8-5-6-10(14)12-11-8/h1-6,13H,(H,12,14)
InChIKey
ITUVPRZRSCWUPA-UHFFFAOYSA-N
Compound name
3-(2-hydroxyphenyl)-1H-pyridazin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

54
Patents

188.05858 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.06586 137.6
[M+Na]+ 211.04780 147.3
[M-H]- 187.05130 139.7
[M+NH4]+ 206.09240 153.2
[M+K]+ 227.02174 142.5
[M+H-H2O]+ 171.05584 129.9
[M+HCOO]- 233.05678 158.3
[M+CH3COO]- 247.07243 150.3
[M+Na-2H]- 209.03325 145.6
[M]+ 188.05803 135.5
[M]- 188.05913 135.5
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