CID 10967369

1222-43-1

Structural Information

Molecular Formula
C12H12N2O5
SMILES
CN1C2=CC(=C(C=C2N=C(C1=O)C(=O)O)OC)OC
InChI
InChI=1S/C12H12N2O5/c1-14-7-5-9(19-3)8(18-2)4-6(7)13-10(11(14)15)12(16)17/h4-5H,1-3H3,(H,16,17)
InChIKey
AAFOBWIAEKIODG-UHFFFAOYSA-N
Compound name
6,7-dimethoxy-4-methyl-3-oxoquinoxaline-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

264.07462 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.08190 154.2
[M+Na]+ 287.06384 165.6
[M-H]- 263.06734 156.0
[M+NH4]+ 282.10844 169.1
[M+K]+ 303.03778 163.3
[M+H-H2O]+ 247.07188 146.8
[M+HCOO]- 309.07282 173.7
[M+CH3COO]- 323.08847 196.7
[M+Na-2H]- 285.04929 159.1
[M]+ 264.07407 160.2
[M]- 264.07517 160.2
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