CID 45071809

858243-97-7

Structural Information

Molecular Formula

C₅H₅N₃O₃

SMILES

C1=C(NC(=O)NC1=O)NC=O

InChI

InChI=1S/C5H5N3O3/c9-2-6-3-1-4(10)8-5(11)7-3/h1-2H,(H3,6,7,8,9,10,11)

InChIKey

FNJSQTSRRARDOT-UHFFFAOYSA-N

Compound name

N-(2,4-dioxo-1H-pyrimidin-6-yl)formamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 155.0331 Da
Monoisotopic Mass: -1.7
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]+	156.04038	127.6
[M+Na]+	178.02232	138.9
[M+NH4]+	173.06692	132.9
[M+K]+	193.99626	135.0
[M-H]-	154.02582	126.3
[M+Na-2H]-	176.00777	132.6
[M]+	155.03255	128.3
[M]-	155.03365	128.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.