CID 70040967

1-amino-5-bromo-1,2-dihydropyridin-2-one

Structural Information

Molecular Formula

C₅H₅BrN₂O

SMILES

C1=CC(=O)N(C=C1Br)N

InChI

InChI=1S/C5H5BrN2O/c6-4-1-2-5(9)8(7)3-4/h1-3H,7H2

InChIKey

AOPGVTUEFBGYPX-UHFFFAOYSA-N

Compound name

1-amino-5-bromopyridin-2-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 187.95853 Da
Monoisotopic Mass: 0.1
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]+	188.96581	128.2
[M+Na]+	210.94775	131.9
[M+NH4]+	205.99235	132.9
[M+K]+	226.92169	132.5
[M-H]-	186.95125	128.7
[M+Na-2H]-	208.93320	132.3
[M]+	187.95798	127.6
[M]-	187.95908	127.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.