CID 15718183

358780-20-8

Structural Information

Molecular Formula

C₉H₇BrN₂O

SMILES

C1=CC2=NC=C(N2C=C1)C(=O)CBr

InChI

InChI=1S/C9H7BrN2O/c10-5-8(13)7-6-11-9-3-1-2-4-12(7)9/h1-4,6H,5H2

InChIKey

QGFGDFNPKLHQRE-UHFFFAOYSA-N

Compound name

2-bromo-1-imidazo[1,2-a]pyridin-3-ylethanone

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 237.97418 Da
Monoisotopic Mass: 2.6
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]+	238.98146	141.1
[M+Na]+	260.96340	154.9
[M-H]-	236.96690	146.5
[M+NH4]+	256.00800	162.9
[M+K]+	276.93734	144.1
[M+H-H2O]+	220.97144	140.8
[M+HCOO]-	282.97238	162.4
[M+CH3COO]-	296.98803	156.9
[M+Na-2H]-	258.94885	149.9
[M]+	237.97363	162.1
[M]-	237.97473	162.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe