CID 1471088

3-chloro-1-methyl-1,2-dihydroquinoxalin-2-one

Structural Information

Molecular Formula
C9H7ClN2O
SMILES
CN1C2=CC=CC=C2N=C(C1=O)Cl
InChI
InChI=1S/C9H7ClN2O/c1-12-7-5-3-2-4-6(7)11-8(10)9(12)13/h2-5H,1H3
InChIKey
AVOGNDGKQXBUOJ-UHFFFAOYSA-N
Compound name
3-chloro-1-methylquinoxalin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

194.02469 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.031966 135.2
[M+Na]+ 217.013908 147.9
[M-H]- 193.017414 137.8
[M+NH4]+ 212.058513 154.6
[M+K]+ 232.987848 143.1
[M+H-H2O]+ 177.021950 128.7
[M+HCOO]- 239.022891 152.7
[M+CH3COO]- 253.038541 149.4
[M+Na-2H]- 214.999356 144.1
[M]+ 194.02414142 138.7
[M]- 194.02523858 138.7
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

patents stripe