CID 43839726

1h,2h,2ah,3h,4h-azeto[1,2-a]quinoxalin-3-one

Structural Information

Molecular Formula
C10H10N2O
SMILES
C1CN2C1C(=O)NC3=CC=CC=C32
InChI
InChI=1S/C10H10N2O/c13-10-9-5-6-12(9)8-4-2-1-3-7(8)11-10/h1-4,9H,5-6H2,(H,11,13)
InChIKey
NPCUJEZPFNNWTL-UHFFFAOYSA-N
Compound name
1,2,2a,4-tetrahydroazeto[1,2-a]quinoxalin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.07932 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.08660 132.5
[M+Na]+ 197.06854 140.3
[M-H]- 173.07204 133.6
[M+NH4]+ 192.11314 145.3
[M+K]+ 213.04248 139.5
[M+H-H2O]+ 157.07658 120.6
[M+HCOO]- 219.07752 148.3
[M+CH3COO]- 233.09317 144.4
[M+Na-2H]- 195.05399 140.8
[M]+ 174.07877 138.0
[M]- 174.07987 138.0
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.