CID 13873118

2-bromo-4-methoxypyridin-3-amine

Structural Information

Molecular Formula

C₆H₇BrN₂O

SMILES

COC1=C(C(=NC=C1)Br)N

InChI

InChI=1S/C6H7BrN2O/c1-10-4-2-3-9-6(7)5(4)8/h2-3H,8H2,1H3

InChIKey

JAABPGVJVYZBDJ-UHFFFAOYSA-N

Compound name

2-bromo-4-methoxypyridin-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 34
Patents: 201.97418 Da
Monoisotopic Mass: 1.2
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]+	202.98146	133.6
[M+Na]+	224.96340	137.1
[M+NH4]+	220.00800	138.4
[M+K]+	240.93734	137.4
[M-H]-	200.96690	134.2
[M+Na-2H]-	222.94885	137.5
[M]+	201.97363	133.0
[M]-	201.97473	133.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe