CID 4050391

20197-80-2

Structural Information

Molecular Formula
C12H14N2O4
SMILES
CCOC1=C(C=C2C(=C1)C(=O)NC(=O)N2)OCC
InChI
InChI=1S/C12H14N2O4/c1-3-17-9-5-7-8(6-10(9)18-4-2)13-12(16)14-11(7)15/h5-6H,3-4H2,1-2H3,(H2,13,14,15,16)
InChIKey
WIGJUGVJWIECFL-UHFFFAOYSA-N
Compound name
6,7-diethoxy-1H-quinazoline-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

250.09535 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 251.10263 154.3
[M+Na]+ 273.08457 167.7
[M+NH4]+ 268.12917 160.0
[M+K]+ 289.05851 162.1
[M-H]- 249.08807 153.7
[M+Na-2H]- 271.07002 158.5
[M]+ 250.09480 155.8
[M]- 250.09590 155.8
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.