CID 165771152

4-(pyridin-3-yl)-1,2,3,4-tetrahydroquinoxalin-2-one

Structural Information

Molecular Formula
C13H11N3O
SMILES
C1C(=O)NC2=CC=CC=C2N1C3=CN=CC=C3
InChI
InChI=1S/C13H11N3O/c17-13-9-16(10-4-3-7-14-8-10)12-6-2-1-5-11(12)15-13/h1-8H,9H2,(H,15,17)
InChIKey
FFVZNEBJCKIPGK-UHFFFAOYSA-N
Compound name
4-pyridin-3-yl-1,3-dihydroquinoxalin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.09021 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.09749 150.7
[M+Na]+ 248.07943 166.1
[M+NH4]+ 243.12403 158.9
[M+K]+ 264.05337 158.2
[M-H]- 224.08293 153.9
[M+Na-2H]- 246.06488 159.2
[M]+ 225.08966 153.8
[M]- 225.09076 153.8
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.