CID 698550

1,4-dihydro-6-methoxy-2,3-quinoxalinedione

Structural Information

Molecular Formula
C9H8N2O3
SMILES
COC1=CC2=C(C=C1)NC(=O)C(=O)N2
InChI
InChI=1S/C9H8N2O3/c1-14-5-2-3-6-7(4-5)11-9(13)8(12)10-6/h2-4H,1H3,(H,10,12)(H,11,13)
InChIKey
CHTYMWBYHAIEOF-UHFFFAOYSA-N
Compound name
6-methoxy-1,4-dihydroquinoxaline-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

95
Patents

192.0535 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.060776 136.4
[M+Na]+ 215.042718 147.7
[M-H]- 191.046224 136.6
[M+NH4]+ 210.087323 153.4
[M+K]+ 231.016658 143.2
[M+H-H2O]+ 175.050760 129.7
[M+HCOO]- 237.051701 156.2
[M+CH3COO]- 251.067351 177.3
[M+Na-2H]- 213.028166 144.8
[M]+ 192.05295142 136.6
[M]- 192.05404858 136.6
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

patents stripe