CID 16093129

8-bromo-5-chloro-1,6-naphthyridine

Structural Information

Molecular Formula

C₈H₄BrClN₂

SMILES

C1=CC2=C(C(=CN=C2Cl)Br)N=C1

InChI

InChI=1S/C8H4BrClN2/c9-6-4-12-8(10)5-2-1-3-11-7(5)6/h1-4H

InChIKey

LAJYLYMBZVFAEY-UHFFFAOYSA-N

Compound name

8-bromo-5-chloro-1,6-naphthyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 241.92464 Da
Monoisotopic Mass: 2.8
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]+	242.93192	139.1
[M+Na]+	264.91386	146.3
[M+NH4]+	259.95846	145.4
[M+K]+	280.88780	144.2
[M-H]-	240.91736	140.5
[M+Na-2H]-	262.89931	144.8
[M]+	241.92409	139.8
[M]-	241.92519	139.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe