CID 46864086

2-bromopyrimidin-5-ol

Structural Information

Molecular Formula

C₄H₃BrN₂O

SMILES

C1=C(C=NC(=N1)Br)O

InChI

InChI=1S/C4H3BrN2O/c5-4-6-1-3(8)2-7-4/h1-2,8H

InChIKey

QHUDDDWGZQPDIC-UHFFFAOYSA-N

Compound name

2-bromopyrimidin-5-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 158
Patents: 173.94289 Da
Monoisotopic Mass: 0.9
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]+	174.95017	125.8
[M+Na]+	196.93211	129.9
[M+NH4]+	191.97671	130.4
[M+K]+	212.90605	130.5
[M-H]-	172.93561	125.2
[M+Na-2H]-	194.91756	130.2
[M]+	173.94234	124.9
[M]-	173.94344	124.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe