CID 352550

1480-96-2

Structural Information

Molecular Formula

C₅H₅FN₂O₂

SMILES

COC1=NC=C(C(=O)N1)F

InChI

InChI=1S/C5H5FN2O2/c1-10-5-7-2-3(6)4(9)8-5/h2H,1H3,(H,7,8,9)

InChIKey

VMIFBCPINLZNNI-UHFFFAOYSA-N

Compound name

5-fluoro-2-methoxy-1H-pyrimidin-6-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 46
Patents: 144.03351 Da
Monoisotopic Mass: 0.0
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]+	145.04079	125.1
[M+Na]+	167.02273	137.6
[M+NH4]+	162.06733	131.6
[M+K]+	182.99667	132.7
[M-H]-	143.02623	123.6
[M+Na-2H]-	165.00818	131.0
[M]+	144.03296	126.2
[M]-	144.03406	126.2

Literature stripe

literature stripe

Patent stripe

patents stripe