CID 619180

5,6-diphenylpyrazin-2-ol

Structural Information

Molecular Formula
C16H12N2O
SMILES
C1=CC=C(C=C1)C2=C(N=CC(=O)N2)C3=CC=CC=C3
InChI
InChI=1S/C16H12N2O/c19-14-11-17-15(12-7-3-1-4-8-12)16(18-14)13-9-5-2-6-10-13/h1-11H,(H,18,19)
InChIKey
LTWBZUZTTUVPIM-UHFFFAOYSA-N
Compound name
5,6-diphenyl-1H-pyrazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

126
Patents

248.09496 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 249.10224 155.6
[M+Na]+ 271.08418 164.4
[M-H]- 247.08768 161.6
[M+NH4]+ 266.12878 168.8
[M+K]+ 287.05812 157.7
[M+H-H2O]+ 231.09222 145.8
[M+HCOO]- 293.09316 176.7
[M+CH3COO]- 307.10881 167.3
[M+Na-2H]- 269.06963 163.3
[M]+ 248.09441 153.2
[M]- 248.09551 153.2
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

No patent data available for this compound.