CID 72219282

2-bromo-6-cyclopropoxypyridine

Structural Information

Molecular Formula

SMILES

C1CC1OC2=NC(=CC=C2)Br

InChI

InChI=1S/C8H8BrNO/c9-7-2-1-3-8(10-7)11-6-4-5-6/h1-3,6H,4-5H2

InChIKey

FQAKZOABQOLCNX-UHFFFAOYSA-N

Compound name

2-bromo-6-cyclopropyloxypyridine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 212.97893 Da
Monoisotopic Mass: 2.7
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]+	213.986206	138.7
[M+Na]+	235.968148	152.5
[M-H]-	211.971654	147.7
[M+NH4]+	231.012753	155.4
[M+K]+	251.942088	141.7
[M+H-H2O]+	195.976190	137.8
[M+HCOO]-	257.977131	160.8
[M+CH3COO]-	271.992781	186.4
[M+Na-2H]-	233.953596	147.8
[M]+	212.97838142	159.2
[M]-	212.97947858	159.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe