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

16
Patents

194.02469 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.03197 135.2
[M+Na]+ 217.01391 147.9
[M-H]- 193.01741 137.8
[M+NH4]+ 212.05851 154.6
[M+K]+ 232.98785 143.1
[M+H-H2O]+ 177.02195 128.7
[M+HCOO]- 239.02289 152.7
[M+CH3COO]- 253.03854 149.4
[M+Na-2H]- 214.99936 144.1
[M]+ 194.02414 138.7
[M]- 194.02524 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