CID 326067

4156-75-6

Structural Information

Molecular Formula

C₆H₄N₂O₄

SMILES

C1C2=C(C(=O)O1)NC(=O)NC2=O

InChI

InChI=1S/C6H4N2O4/c9-4-2-1-12-5(10)3(2)7-6(11)8-4/h1H2,(H2,7,8,9,11)

InChIKey

MFHLWNMYHQMDMV-UHFFFAOYSA-N

Compound name

1,5-dihydrofuro[3,4-d]pyrimidine-2,4,7-trione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 4
References: 12
Patents: 168.0171 Da
Monoisotopic Mass: -1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	169.02438	129.6
[M+Na]+	191.00632	141.3
[M+NH4]+	186.05092	135.6
[M+K]+	206.98026	139.8
[M-H]-	167.00982	129.0
[M+Na-2H]-	188.99177	132.1
[M]+	168.01655	130.6
[M]-	168.01765	130.6

Literature stripe

literature stripe

Patent stripe

patents stripe